A0A087X8F1_POEFO Loading...

Large ribosomal subunit protein uL18m

Together with thiosulfate sulfurtransferase (TST), acts as a mitochondrial import factor for the cytosolic 5S rRNA. The precursor form shows RNA chaperone activity; is able to fold the 5S rRNA into an import-competent conformation that is recognized by rhodanese (TST). Both the cytoplasmic and mitochondrial forms are able to bind to the helix IV-loop D in the gamma domain of the 5S rRNA.

AlphaFold DB , UniProt , Accession A0A087X8F1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 189 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.7	Very low	41.9	Very low	246 Å²	246	174.8 Å²	174.8	100%	1.212	86%	0.86	S	S	*	*				0	130.2	0	-56.9	-175.5	-179.5	0	0	107.8
2	A	42.1	Very low	42	Very low	89 Å²	89	172.8 Å²	172.8	74%	0.736	85%	0.854	S	S	*	*			cis	-165.3	124.2	-12.9	0	0	0	0	0	103.8	R4	A2-R4 PolarHBondContact O-N 3.42Å
3	L	39.9	Very low	42.1	Very low	173 Å²	173	172.8 Å²	172.8	91%	0.906	86%	0.858	S	S	*	*			trans	-58	128.9	167.3	-80.7	133.8	0	0	0	108.7
4	R	35.7	Very low	41.9	Very low	241 Å²	241	172.3 Å²	172.3	91%	0.909	86%	0.855	S	S	*	*			trans	-120.9	96.2	163.2	-87.7	-170.6	169.2	-173.6	-1.9	110	A2	A2-R4 PolarHBondContact O-N 3.42Å
5	Q	39.1	Very low	41.8	Very low	166 Å²	166	165.5 Å²	165.5	78%	0.776	85%	0.847	S	S	*	*			trans	-56.2	139.6	160	-66.2	-177.1	-26.3	0	0	110.2
6	I	48.3	Very low	42	Very low	155 Å²	155	167.3 Å²	167.3	80%	0.795	85%	0.85	S	S	*	*			trans	-109.7	97.1	164.4	-63.3	174	0	0	0	106.9
7	N	37.5	Very low	42.2	Very low	143 Å²	143	166.5 Å²	166.5	77%	0.765	85%	0.847	S	S	*	*			trans	-74	127	161.4	-101.6	-28.2	0	0	0	108.7
8	R	47.8	Very low	42.5	Very low	225 Å²	225	167.5 Å²	167.5	85%	0.849	85%	0.848	S	S	*	*			trans	-136.6	94.2	153.1	-75.5	-165.9	177.2	-178.8	-0.2	110.1
9	S	40.3	Very low	42.2	Very low	112 Å²	112	171 Å²	171	78%	0.783	85%	0.85	S	S	*	*			trans	-37.9	122.4	158.4	47.4	0	0	0	0	113.9
10	V	45.4	Very low	42	Very low	143 Å²	143	168.8 Å²	168.8	87%	0.867	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-100.5	124.3	160.7	178.9	0	0	0	0	107.8
11	R	44.8	Very low	41.8	Very low	230 Å²	230	164.5 Å²	164.5	87%	0.868	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-69.1	132.5	-171.9	-67.7	176	175	-171.9	-3	111.1
12	L	43.9	Very low	41.7	Very low	150 Å²	150	163.7 Å²	163.7	79%	0.785	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-61.4	128.3	158.3	-84.9	112.9	0	0	0	109.5	M14	L12-M14 HydrophobicContact CD2-CE 4.35Å
13	L	43.5	Very low	41.6	Very low	173 Å²	173	162.6 Å²	162.6	91%	0.906	84%	0.836	S	S	*	*			trans	-106.6	100.8	160.5	-85.9	163.3	0	0	0	108.1	G15	L13-G15 PolarHBondContact O-N 3.3Å
14	M	39.3	Very low	41.6	Very low	166 Å²	166	161.2 Å²	161.2	82%	0.818	84%	0.835	S	S	*	*			trans	-70.2	108.3	165.1	-80.7	-79	173.2	0	0	108.4	L12	L12-M14 HydrophobicContact CD2-CE 4.35Å
15	G	39.5	Very low	42.3	Very low	71 Å²	71	154.5 Å²	154.5	73%	0.732	83%	0.831	S	S	*	*			trans	-83.4	127.2	169.4	0	0	0	0	0	110.5	L13	L13-G15 PolarHBondContact O-N 3.3Å
16	Q	45.8	Very low	42.6	Very low	193 Å²	193	150.7 Å²	150.7	90%	0.902	82%	0.822	S	S	*	*			trans	-64.9	136.9	-172.3	-67.4	172	-52.4	0	0	113.1
17	I	45.5	Very low	42.9	Very low	155 Å²	155	153 Å²	153	80%	0.795	83%	0.827	S	S	*	*			trans	-80.5	113.3	173.3	-62.6	165.8	0	0	0	108.3	R19	I17-R19 HydrophobicContact CG2-CG 4.46Å
18	Q	46.3	Very low	43.4	Very low	184 Å²	184	153.8 Å²	153.8	86%	0.86	83%	0.826	S	S	*	*			trans	-90.8	118	161.7	-76.8	-177.5	-13.2	0	0	109.1
19	R	38.6	Very low	43.7	Very low	234 Å²	234	148.7 Å²	148.7	88%	0.883	82%	0.824	S	S	*	*			trans	-81.5	124.2	171.2	-74.2	177.8	171.7	168.7	-2.7	109	I17	I17-R19 HydrophobicContact CG2-CG 4.46Å
20	C	36.6	Very low	44.3	Very low	126 Å²	126	147 Å²	147	85%	0.851	82%	0.817	S	S	*	*			trans	-122.8	118.8	162	-83.6	0	0	0	0	110.2
21	G	38.4	Very low	44.7	Very low	80 Å²	80	151.3 Å²	151.3	83%	0.825	82%	0.818	S	S	*	*				61.8	115	128.5	0	0	0	0	0	120.4
22	F	38.7	Very low	44.8	Very low	228 Å²	228	145.9 Å²	145.9	100%	1	81%	0.813	S	S	*	*			trans	-56.8	136.2	161.4	-106.9	-104.6	0	0	0	112.5
23	G	38.8	Very low	45.5	Very low	67 Å²	67	146.2 Å²	146.2	69%	0.691	82%	0.815	S	S	*	*			trans	-159	106.2	170.6	0	0	0	0	0	112.2
24	V	40	Very low	46.2	Very low	143 Å²	143	141.5 Å²	141.5	87%	0.867	81%	0.809	S	S	*	*			trans	40.9	118.8	152.1	-167.6	0	0	0	0	119.3	S26	V24-S26 PolarHBondContact O-N 3.32Å
25	A	50.7	Low	47.5	Very low	100 Å²	100	142.5 Å²	142.5	83%	0.826	81%	0.812	S	S	*	*			trans	-56.1	119.6	170.4	0	0	0	0	0	112.5
26	S	45.3	Very low	48.8	Very low	86 Å²	86	143.6 Å²	143.6	60%	0.601	81%	0.814	S	S	*	*			trans	-112.7	113.7	161.6	-172	0	0	0	0	109.3	V24 H28	V24-S26 PolarHBondContact O-N 3.32Å; S26-H28 PolarHBondContact O-N 3.42Å; S26-H28 VanDerWaalsContact O-N 3.14Å; S26-H28 PolarHBondContact OG-CD2 3.44Å; S26-H28 PolarHBondContact OG-NE2 3.27Å
27	K	54	Low	49.7	Very low	205 Å²	205	138.8 Å²	138.8	89%	0.891	81%	0.807	S	S	*	*			trans	-78.7	87.1	172.8	-70.2	-178.9	-179.7	177.8	0	108.6
28	H	48.6	Very low	50.7	Low	159 Å²	159	136 Å²	136	74%	0.736	81%	0.807	S	S	*	*			trans	-117.3	93.6	162.4	-69.6	-61.2	0	0	0	109.9	S26 A30	S26-H28 PolarHBondContact O-N 3.42Å; S26-H28 VanDerWaalsContact O-N 3.14Å; S26-H28 PolarHBondContact OG-CD2 3.44Å; S26-H28 PolarHBondContact OG-NE2 3.27Å; H28-A30 PolarHBondContact O-N 2.95Å
29	S	54.7	Low	51.6	Low	118 Å²	118	138.1 Å²	138.1	83%	0.825	81%	0.807	S	S	*	*			trans	-71	88	158.2	171.9	0	0	0	0	107.8
30	A	51.3	Low	53.1	Low	76 Å²	76	132.7 Å²	132.7	63%	0.628	80%	0.802	S	S	*	*			trans	-113.3	88.4	163.7	0	0	0	0	0	107.8	H28 C32	H28-A30 PolarHBondContact O-N 2.95Å; A30-C32 PolarHBondContact O-N 3.35Å
31	R	54	Low	54.6	Low	234 Å²	234	134.6 Å²	134.6	88%	0.883	80%	0.799	S	S	*	*			trans	-66.2	83.6	160.5	-114	-176	-86.1	170.7	-7.5	106.8	L33	R31-L33 PolarHBondContact O-N 3.32Å; R31-L33 VanDerWaalsContact O-N 3.16Å
32	C	47.4	Very low	56.1	Low	115 Å²	115	136.1 Å²	136.1	78%	0.777	79%	0.794	S	S	*	*			trans	-77.2	96.9	165.6	-72.5	0	0	0	0	107	A30 G34	A30-C32 PolarHBondContact O-N 3.35Å; C32-G34 VanDerWaalsContact C-N 3.33Å; C32-G34 PolarHBondContact O-N 3.22Å
33	L	59.3	Low	57.8	Low	157 Å²	157	131.2 Å²	131.2	82%	0.822	78%	0.783	S	S	*	*			trans	-59.5	103.5	158.2	-74.1	163.6	0	0	0	106	R31 Q35	R31-L33 PolarHBondContact O-N 3.32Å; R31-L33 VanDerWaalsContact O-N 3.16Å; L33-Q35 VanDerWaalsContact C-N 3.31Å; L33-Q35 PolarHBondContact O-N 3.48Å
34	G	58.1	Low	59.5	Low	75 Å²	75	133.8 Å²	133.8	77%	0.773	79%	0.788	S	S	*	*			trans	-60.2	101.7	164.4	0	0	0	0	0	106.8	C32 A36	C32-G34 VanDerWaalsContact C-N 3.33Å; C32-G34 PolarHBondContact O-N 3.22Å; G34-A36 VanDerWaalsContact C-N 3.32Å; G34-A36 PolarHBondContact O-N 3.29Å
35	Q	67	Low	61.5	Low	187 Å²	187	130.5 Å²	130.5	87%	0.874	77%	0.765	S	S	*	*			trans	-63	104.3	165.2	-81	177.4	-31.5	0	0	105.6	L33 A37	L33-Q35 VanDerWaalsContact C-N 3.31Å; L33-Q35 PolarHBondContact O-N 3.48Å; Q35-A37 PolarHBondContact O-N 2.88Å; Q35-A37 VanDerWaalsContact O-N 3.12Å
36	A	66.1	Low	63	Low	94 Å²	94	134 Å²	134	78%	0.777	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-52.3	122.3	167.2	0	0	0	0	0	106.6	G34 A38	G34-A36 VanDerWaalsContact C-N 3.32Å; G34-A36 PolarHBondContact O-N 3.29Å; A36-A38 PolarHBondContact O-N 3.17Å
37	A	63.4	Low	64.9	Low	92 Å²	92	136.8 Å²	136.8	76%	0.76	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-48.3	130.3	179	0	0	0	0	0	108.9	Q35 R39	Q35-A37 PolarHBondContact O-N 2.88Å; Q35-A37 VanDerWaalsContact O-N 3.12Å; A37-R39 PolarHBondContact O-N 3.43Å; A37-R39 VanDerWaalsContact O-N 3.08Å
38	A	68	Low	66.4	Low	97 Å²	97	133.7 Å²	133.7	80%	0.802	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-51.1	122.5	175.5	0	0	0	0	0	107.6	A36	A36-A38 PolarHBondContact O-N 3.17Å
39	R	64.9	Low	68.3	Low	228 Å²	228	130.3 Å²	130.3	86%	0.86	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-56.6	130	176.2	-70.7	-178.6	177	176.3	-0.9	106.4	A37 E41	A37-R39 PolarHBondContact O-N 3.43Å; A37-R39 VanDerWaalsContact O-N 3.08Å; R39-E41 PolarHBondContact O-N 3.37Å
40	P	69.4	Low	70	Confident	120 Å²	120	130.4 Å²	130.4	78%	0.779	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-54.1	131.9	175.8	21.6	-30.5	0	0	0	108.1
41	E	68.8	Low	71.9	Confident	165 Å²	165	132.1 Å²	132.1	77%	0.771	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-49.5	131.6	176.7	-70.7	-64.4	152.5	0	0	108.5	R39 T43	R39-E41 PolarHBondContact O-N 3.37Å; E41-T43 PolarHBondContact O-N 3.4Å
42	P	70.7	Confident	73.8	Confident	112 Å²	112	127.3 Å²	127.3	73%	0.727	75%	0.754	S	S	*	*			trans	-60.1	110.3	-178.7	24.2	-31.5	0	0	0	108.1
43	T	72.3	Confident	76.1	Confident	125 Å²	125	126.3 Å²	126.3	77%	0.767	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-59.2	126.1	172.9	48.9	0	0	0	0	107.4	E41 N45	E41-T43 PolarHBondContact O-N 3.4Å; T43-N45 PolarHBondContact O-N 3.18Å
44	P	74.6	Confident	77.8	Confident	122 Å²	122	127.1 Å²	127.1	79%	0.792	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-57.7	117.6	-178.1	20.4	-29.7	0	0	0	108.7	E46	P44-E46 PolarHBondContact O-N 3.44Å
45	N	82.8	Confident	79.6	Confident	73 Å²	73	128.8 Å²	128.8	39%	0.39	74%	0.737	S	S	.	*	P	Polyproline II helix	trans	-69.5	119.9	178.7	178	6.6	0	0	0	107.8	T43 N47 E48	T43-N45 PolarHBondContact O-N 3.18Å; N45-N47 PolarHBondContact O-N 2.91Å; N45-N47 PolarHBondContact OD1-N 3.46Å; N45-N47 PolarHBondContact OD1-ND2 3.06Å; N45-E48 HydrophobicContact CB-CG 4.05Å; N45-E48 WeakPolarHBondContact CB-OE1 3.42Å; N45-E48 PolarHBondContact ND2-OE1 3.48Å; N45-E48 VanDerWaalsContact ND2-OE1 3.17Å; N45-E48 WeakPolarHBondContact O-CB 3.48Å; N45-E48 PolarHBondContact O-N 2.61Å
46	E	81.4	Confident	81.1	Confident	175 Å²	175	123.3 Å²	123.3	82%	0.818	71%	0.713	S	S	*	*	G	3₁₀ helix	trans	-57.5	-25.5	-176.7	-62.7	-180	169.5	0	0	112.5	P44 E48 A49	P44-E46 PolarHBondContact O-N 3.44Å; E46-E48 PolarHBondContact O-N 3.35Å; E46-A49 WeakPolarHBondContact O-CB 3.35Å; E46-A49 PolarHBondContact O-N 3.47Å
47	N	85.4	Confident	82.5	Confident	143 Å²	143	130 Å²	130	77%	0.765	72%	0.719	S	S	*	*	G	3₁₀ helix	trans	-70.4	-16.5	175.7	-61.1	-63.2	0	0	0	114	N45 A49	N45-N47 PolarHBondContact O-N 2.91Å; N45-N47 PolarHBondContact OD1-N 3.46Å; N45-N47 PolarHBondContact OD1-ND2 3.06Å; N47-A49 VanDerWaalsContact C-N 3.35Å
48	E	86.8	Confident	84	Confident	140 Å²	140	129.2 Å²	129.2	65%	0.654	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-88.7	-6.4	178.5	-66.5	169.6	-156.7	0	0	112.3	N45 E46 V50	N45-E48 HydrophobicContact CB-CG 4.05Å; N45-E48 WeakPolarHBondContact CB-OE1 3.42Å; N45-E48 PolarHBondContact ND2-OE1 3.48Å; N45-E48 VanDerWaalsContact ND2-OE1 3.17Å; N45-E48 WeakPolarHBondContact O-CB 3.48Å; N45-E48 PolarHBondContact O-N 2.61Å; E46-E48 PolarHBondContact O-N 3.35Å; E48-V50 VanDerWaalsContact C-N 3.29Å; E48-V50 PolarHBondContact O-N 2.82Å
49	A	87.7	Confident	85.2	Confident	89 Å²	89	129.8 Å²	129.8	74%	0.736	70%	0.697	S	S	*	*			trans	-72.7	80.1	175.4	0	0	0	0	0	111.2	E46 N47	E46-A49 WeakPolarHBondContact O-CB 3.35Å; E46-A49 PolarHBondContact O-N 3.47Å; N47-A49 VanDerWaalsContact C-N 3.35Å
50	V	90.1	Very high	86.6	Confident	119 Å²	119	121.7 Å²	121.7	72%	0.721	67%	0.666	S	S	*	*			trans	-95.9	137.9	177.7	-175.4	0	0	0	0	110.5	E48	E48-V50 VanDerWaalsContact C-N 3.29Å; E48-V50 PolarHBondContact O-N 2.82Å
51	N	92.4	Very high	87.9	Confident	113 Å²	113	118.2 Å²	118.2	60%	0.604	64%	0.641	S	S	*	*			trans	-63.4	132.5	174.6	-171.9	-32.7	0	0	0	110.2	T53	N51-T53 PolarHBondContact O-N 3.4Å; N51-T53 VanDerWaalsContact O-N 3.11Å; N51-T53 PolarHBondContact OD1-N 3Å; N51-T53 PolarHBondContact OD1-O 3.32Å
52	P	93.9	Very high	89.1	Confident	132 Å²	132	114.7 Å²	114.7	86%	0.857	63%	0.627	S	S	*	*	S	Bend	trans	-56.7	-26.8	176.2	22.9	-35.7	0	0	0	113.5
53	T	95.6	Very high	90.2	Very high	95 Å²	95	110.6 Å²	110.6	58%	0.583	60%	0.598	S	S	*	*	S	Bend	trans	-109.2	117.5	176.8	-56	0	0	0	0	111.1	N51 V55	N51-T53 PolarHBondContact O-N 3.4Å; N51-T53 VanDerWaalsContact O-N 3.11Å; N51-T53 PolarHBondContact OD1-N 3Å; N51-T53 PolarHBondContact OD1-O 3.32Å; T53-V55 HydrophobicContact CG2-CG2 4.39Å
54	F	95.3	Very high	91.2	Very high	174 Å²	174	112.5 Å²	112.5	76%	0.763	59%	0.591	S	S	*	*			trans	-92.4	121.9	174	179.8	-104.4	0	0	0	111.7	N56	F54-N56 HydrophobicContact CE1-CB 3.85Å
55	V	95.7	Very high	92.1	Very high	110 Å²	110	110.5 Å²	110.5	67%	0.667	57%	0.573	S	S	*	*			trans	-106.9	112.2	178.9	-177.8	0	0	0	0	110.5	T53	T53-V55 HydrophobicContact CG2-CG2 4.39Å
56	N	96.8	Very high	92.6	Very high	72 Å²	72	107.3 Å²	107.3	39%	0.385	56%	0.556	S	S	.	*			trans	-97.8	123.8	173.5	-168.7	-18.6	0	0	0	111.1	F54 N58 N61	F54-N56 HydrophobicContact CE1-CB 3.85Å; N56-N58 VanDerWaalsContact OD1-CB 3.27Å; N56-N58 WeakPolarHBondContact OD1-CB 3.35Å; N56-N58 PolarHBondContact OD1-N 3.47Å; N56-N61 PolarHBondContact ND2-ND2 2.97Å; N56-N61 VanDerWaalsContact ND2-ND2 3.12Å
57	R	96.9	Very high	93.3	Very high	235 Å²	235	101.4 Å²	101.4	89%	0.887	53%	0.53	S	S	*	.			trans	-91	-3.2	-179.8	-60.7	179.5	-177.2	169.2	0.4	114.3	P59	R57-P59 WeakPolarHBondContact O-CD 3.35Å
58	N	95.4	Very high	93.7	Very high	75 Å²	75	95.2 Å²	95.2	40%	0.401	50%	0.499	S	S	.	.			trans	-72.7	118.8	-178.8	179.7	-4.6	0	0	0	111	N56 R60 N61	N56-N58 VanDerWaalsContact OD1-CB 3.27Å; N56-N58 WeakPolarHBondContact OD1-CB 3.35Å; N56-N58 PolarHBondContact OD1-N 3.47Å; N58-R60 PolarHBondContact O-N 2.91Å; N58-R60 PolarHBondContact OD1-N 3.29Å; N58-N61 HydrophobicContact CB-CB 4.31Å; N58-N61 WeakPolarHBondContact O-CB 3.41Å; N58-N61 PolarHBondContact O-N 2.96Å
59	P	93.2	Very high	94.1	Very high	109 Å²	109	93.3 Å²	93.3	71%	0.708	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-30.1	-177.9	24.2	-34.2	0	0	0	113	R57 N61	R57-P59 WeakPolarHBondContact O-CD 3.35Å; P59-N61 PolarHBondContact O-N 3.05Å
60	R	93.3	Very high	94.3	Very high	58 Å²	58	89.7 Å²	89.7	22%	0.219	46%	0.464	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-3.7	-175.9	-61.3	-172.8	66.8	-156.8	-6	113.9	N58 E63 R64 A146 G147	N58-R60 PolarHBondContact O-N 2.91Å; N58-R60 PolarHBondContact OD1-N 3.29Å; R60-E63 IonicContact NE-OE2 3.96Å; R60-E63 PolarHBondContact O-N 2.93Å; R60-R64 WeakPolarHBondContact O-CG 3.39Å; R60-R64 PolarHBondContact O-N 3.35Å; R60-R64 VanDerWaalsContact O-N 3.09Å; R60-A146 PolarHBondContact NH1-O 3.31Å; R60-G147 PolarHBondContact NH2-O 3.34Å
61	N	95.9	Very high	94.5	Very high	46 Å²	46	87.3 Å²	87.3	25%	0.246	45%	0.447	C	S	.	.	H	α-helix	trans	-62.1	-50.6	-174.6	-175.5	41.6	0	0	0	111.9	N56 N58 P59 E63 R64 M65	N56-N61 PolarHBondContact ND2-ND2 2.97Å; N56-N61 VanDerWaalsContact ND2-ND2 3.12Å; N58-N61 HydrophobicContact CB-CB 4.31Å; N58-N61 WeakPolarHBondContact O-CB 3.41Å; N58-N61 PolarHBondContact O-N 2.96Å; P59-N61 PolarHBondContact O-N 3.05Å; N61-E63 VanDerWaalsContact C-N 3.3Å; N61-E63 PolarHBondContact O-N 3.37Å; N61-R64 PolarHBondContact O-N 3.04Å; N61-M65 PolarHBondContact O-N 2.97Å
62	L	94.4	Very high	94.3	Very high	91 Å²	91	87.5 Å²	87.5	48%	0.476	44%	0.44	S	S	.	.	H	α-helix	trans	-67	-32.1	-178.8	-63.8	-179.3	0	0	0	112.5	M65 A66 L67 A68	L62-M65 HydrophobicContact CD2-CE 3.65Å; L62-A66 PolarHBondContact O-N 3.14Å; L62-L67 HydrophobicContact CD2-CB 4.48Å; L62-L67 PolarHBondContact O-N 3.22Å; L62-A68 HydrophobicContact CB-CB 3.7Å; L62-A68 PolarHBondContact O-N 2.68Å
63	E	93.9	Very high	94.1	Very high	27 Å²	27	83.5 Å²	83.5	13%	0.126	42%	0.422	C	S	.	.	H	α-helix	trans	-64.8	-45.9	175.9	-59.6	175.4	165.4	0	0	110.9	R60 N61 M65 A66 A68 Y84 H85	R60-E63 IonicContact NE-OE2 3.96Å; R60-E63 PolarHBondContact O-N 2.93Å; N61-E63 VanDerWaalsContact C-N 3.3Å; N61-E63 PolarHBondContact O-N 3.37Å; E63-M65 VanDerWaalsContact C-N 3.31Å; E63-M65 PolarHBondContact O-N 2.96Å; E63-A66 PolarHBondContact O-N 2.99Å; E63-A68 HydrophobicContact CB-CB 4.49Å; E63-A68 HydrophobicContact CG-CB 3.98Å; E63-Y84 HydrophobicContact CB-CD1 4.47Å; E63-Y84 HydrophobicContact CB-CD2 4.34Å; E63-Y84 HydrophobicContact CB-CG 4.25Å; E63-Y84 HydrophobicContact CG-CD1 4.04Å; E63-Y84 HydrophobicContact CG-CE1 4.49Å; E63-Y84 HydrophobicContact CG-CG 4.19Å; E63-H85 IonicContact OE2-NE2 3.8Å
64	R	93.3	Very high	93.8	Very high	164 Å²	164	84.2 Å²	84.2	62%	0.619	41%	0.414	S	S	*	.	H	α-helix	trans	-63.1	-36.1	178.4	-73.7	-178.8	176.1	-166.7	-0.5	112.5	R60 N61 A66	R60-R64 WeakPolarHBondContact O-CG 3.39Å; R60-R64 PolarHBondContact O-N 3.35Å; R60-R64 VanDerWaalsContact O-N 3.09Å; N61-R64 PolarHBondContact O-N 3.04Å; R64-A66 PolarHBondContact O-N 3.28Å
65	M	94	Very high	93.6	Very high	81 Å²	81	84.8 Å²	84.8	40%	0.399	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-4.7	175	-63.1	-170.5	-63.5	0	0	113.8	N61 L62 E63 L67	N61-M65 PolarHBondContact O-N 2.97Å; L62-M65 HydrophobicContact CD2-CE 3.65Å; E63-M65 VanDerWaalsContact C-N 3.31Å; E63-M65 PolarHBondContact O-N 2.96Å; M65-L67 HydrophobicContact CB-CB 4.49Å; M65-L67 HydrophobicContact CB-CD1 4.08Å; M65-L67 HydrophobicContact CB-CG 4.1Å; M65-L67 HydrophobicContact CE-CD1 3.99Å; M65-L67 PolarHBondContact O-N 3.4Å; M65-L67 HydrophobicContact SD-CD1 4.39Å
66	A	94.3	Very high	93.6	Very high	6 Å²	6	86.3 Å²	86.3	5%	0.05	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.4	28.7	-171.6	0	0	0	0	0	114.1	L62 E63 R64 P182 R184 K185	L62-A66 PolarHBondContact O-N 3.14Å; E63-A66 PolarHBondContact O-N 2.99Å; R64-A66 PolarHBondContact O-N 3.28Å; A66-P182 HydrophobicContact CB-CB 4.18Å; A66-P182 HydrophobicContact CB-CG 3.87Å; A66-R184 CarbonylContact O-C 3.54Å; A66-R184 VanDerWaalsContact O-CA 3.28Å; A66-R184 WeakPolarHBondContact O-CA 3.24Å; A66-K185 PolarHBondContact O-N 3.37Å
67	L	94.8	Very high	93.4	Very high	50 Å²	50	86.2 Å²	86.2	26%	0.262	43%	0.428	S	S	.	.			trans	-99.1	-25.3	177.5	-69.1	175.8	0	0	0	112.5	L62 M65 R184 K185 V187	L62-L67 HydrophobicContact CD2-CB 4.48Å; L62-L67 PolarHBondContact O-N 3.22Å; M65-L67 HydrophobicContact CB-CB 4.49Å; M65-L67 HydrophobicContact CB-CD1 4.08Å; M65-L67 HydrophobicContact CB-CG 4.1Å; M65-L67 HydrophobicContact CE-CD1 3.99Å; M65-L67 PolarHBondContact O-N 3.4Å; M65-L67 HydrophobicContact SD-CD1 4.39Å; L67-R184 PolarHBondContact O-NE 2.89Å; L67-K185 HydrophobicContact CD2-CB 3.86Å; L67-V187 HydrophobicContact CD2-CG2 3.76Å
68	A	94.7	Very high	93.1	Very high	13 Å²	13	81.8 Å²	81.8	11%	0.107	41%	0.412	C	S	.	.	S	Bend	trans	-53.1	139.8	179.8	0	0	0	0	0	111.7	L62 E63 K70 Y84 R184	L62-A68 HydrophobicContact CB-CB 3.7Å; L62-A68 PolarHBondContact O-N 2.68Å; E63-A68 HydrophobicContact CB-CB 4.49Å; E63-A68 HydrophobicContact CG-CB 3.98Å; A68-K70 PolarHBondContact O-N 3.02Å; A68-Y84 HydrophobicContact CB-CD1 4.23Å; A68-Y84 HydrophobicContact CB-CE1 3.43Å; A68-Y84 VanDerWaalsContact CB-CE1 3.43Å; A68-Y84 WeakPolarHBondContact O-CE1 3.4Å; A68-Y84 PolarHBondContact O-OH 3.26Å; A68-R184 WeakPolarHBondContact O-CD 3.48Å
69	V	93.7	Very high	92.8	Very high	100 Å²	100	80 Å²	80	61%	0.606	40%	0.404	S	S	*	.	P	Polyproline II helix	trans	-66.2	129.6	175	-174	0	0	0	0	108.1
70	K	93.8	Very high	92.7	Very high	13 Å²	13	77.8 Å²	77.8	6%	0.057	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-95.3	147.9	166.6	-62.8	-173.7	-175.8	-168.9	0	108.1	A68 R72 Q82 Y84 E181 P182	A68-K70 PolarHBondContact O-N 3.02Å; K70-R72 PolarHBondContact O-N 3Å; K70-Q82 HydrophobicContact CB-CG 3.73Å; K70-Q82 HydrophobicContact CD-CG 3.95Å; K70-Q82 HydrophobicContact CG-CG 4.49Å; K70-Y84 HydrophobicContact CD-CE1 4.22Å; K70-Y84 HydrophobicContact CG-CD1 3.93Å; K70-Y84 HydrophobicContact CG-CE1 3.41Å; K70-Y84 VanDerWaalsContact CG-CE1 3.41Å; K70-E181 WeakPolarHBondContact CE-OE2 3.36Å; K70-E181 IonicContact NZ-OE2 2.73Å; K70-E181 PolarHBondContact NZ-OE2 2.68Å; K70-P182 PolarHBondContact NZ-O 3.3Å
71	D	92.6	Very high	92.6	Very high	70 Å²	70	78.5 Å²	78.5	37%	0.374	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-65.2	124.3	174.7	-168.5	5.1	0	0	0	110.3	W74 Q81 Q82	D71-W74 VanDerWaalsContact CG-NE1 3.29Å; D71-W74 PolarHBondContact OD1-NE1 2.72Å; D71-W74 PolarHBondContact OD2-NE1 3.05Å; D71-Q81 HydrophobicContact CB-CB 4.16Å; D71-Q81 CarbonylContact O-C 3.6Å; D71-Q82 WeakPolarHBondContact O-CA 3.33Å; D71-Q82 WeakPolarHBondContact O-CB 3.36Å; D71-Q82 PolarHBondContact O-N 3.12Å
72	R	89.8	Confident	92.5	Very high	117 Å²	117	80.6 Å²	80.6	44%	0.442	40%	0.398	S	S	.	.			trans	-121	158.6	-174.7	-72.3	178.5	-177.1	-156	-0.8	109	K70 Y186	K70-R72 PolarHBondContact O-N 3Å; R72-Y186 PolarHBondContact NH1-OH 2.69Å; R72-Y186 VanDerWaalsContact NH2-CZ 3.32Å; R72-Y186 PolarHBondContact NH2-OH 3.04Å
73	G	88.7	Confident	92.5	Very high	48 Å²	48	77.1 Å²	77.1	50%	0.495	38%	0.379	S	S	.	.			trans	107.1	-142	-164.6	0	0	0	0	0	106.9	K75	G73-K75 PolarHBondContact O-N 2.98Å
74	W	90.5	Very high	92.6	Very high	109 Å²	109	76.3 Å²	76.3	41%	0.413	38%	0.375	S	S	.	.			trans	47	33.9	174.2	-48.5	103.1	0	0	0	114.1	D71 T76 H80 Q81	D71-W74 VanDerWaalsContact CG-NE1 3.29Å; D71-W74 PolarHBondContact OD1-NE1 2.72Å; D71-W74 PolarHBondContact OD2-NE1 3.05Å; W74-T76 VanDerWaalsContact C-N 3.31Å; W74-H80 PolarHBondContact O-ND1 3.13Å; W74-Q81 HydrophobicContact CB-CG 4.29Å; W74-Q81 HydrophobicContact CD2-CG 4.07Å; W74-Q81 VanDerWaalsContact CD2-NE2 3.27Å; W74-Q81 HydrophobicContact CG-CB 4.13Å; W74-Q81 HydrophobicContact CG-CG 3.81Å; W74-Q81 VanDerWaalsContact CZ2-NE2 3.33Å
75	K	90.4	Very high	92.8	Very high	187 Å²	187	69.1 Å²	69.1	81%	0.813	35%	0.349	S	S	*	.	S	Bend	trans	-74.9	-28.9	179.6	-70.7	-174.5	179.3	178.5	0	111.3	G73	G73-K75 PolarHBondContact O-N 2.98Å
76	T	94.4	Very high	92.9	Very high	142 Å²	142	68.6 Å²	68.6	87%	0.871	34%	0.342	S	S	*	.	S	Bend	trans	-87.8	-18.8	-178.4	50.6	0	0	0	0	113.1	W74	W74-T76 VanDerWaalsContact C-N 3.31Å
77	T	93.1	Very high	93	Very high	69 Å²	69	68.4 Å²	68.4	42%	0.423	34%	0.34	S	S	.	.	S	Bend	trans	-105.5	135.2	-178.4	-47	0	0	0	0	110.4
78	W	90.5	Very high	93.1	Very high	143 Å²	143	69.9 Å²	69.9	54%	0.542	35%	0.347	S	S	.	.	S	Bend	trans	-101	136.4	169.2	-171.8	98.2	0	0	0	109.5	I156	W78-I156 HydrophobicContact CH2-CD1 4.42Å; W78-I156 HydrophobicContact CH2-CG1 3.63Å; W78-I156 HydrophobicContact CZ2-CG1 3.85Å; W78-I156 HydrophobicContact CZ3-CG1 4.25Å
79	P	90.3	Very high	93.2	Very high	36 Å²	36	70.7 Å²	70.7	23%	0.234	35%	0.348	C	S	.	.	S	Bend	cis	-84.8	158.4	-1.9	33.3	-33.2	0	0	0	113
80	H	90.3	Very high	93.3	Very high	63 Å²	63	67.8 Å²	67.8	29%	0.292	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-65.7	137	175.9	-65.1	-91.4	0	0	0	112	W74 Q82 R154	W74-H80 PolarHBondContact O-ND1 3.13Å; H80-Q82 VanDerWaalsContact C-N 3.29Å; H80-Q82 PolarHBondContact O-N 2.97Å; H80-R154 PolarHBondContact CD2-NH1 3.31Å
81	Q	91	Very high	93.4	Very high	74 Å²	74	74 Å²	74	35%	0.346	36%	0.355	S	S	.	.			trans	-85.4	4.1	-179.6	-53.9	-157.1	37.9	0	0	114.3	D71 W74 F83	D71-Q81 HydrophobicContact CB-CB 4.16Å; D71-Q81 CarbonylContact O-C 3.6Å; W74-Q81 HydrophobicContact CB-CG 4.29Å; W74-Q81 HydrophobicContact CD2-CG 4.07Å; W74-Q81 VanDerWaalsContact CD2-NE2 3.27Å; W74-Q81 HydrophobicContact CG-CB 4.13Å; W74-Q81 HydrophobicContact CG-CG 3.81Å; W74-Q81 VanDerWaalsContact CZ2-NE2 3.33Å; Q81-F83 VanDerWaalsContact C-N 3.33Å; Q81-F83 PolarHBondContact O-N 3.46Å
82	Q	93.5	Very high	93.5	Very high	90 Å²	90	73.5 Å²	73.5	42%	0.421	36%	0.357	S	S	.	.			trans	-80	72.8	-177.3	-165.1	-173.3	3.4	0	0	112.7	K70 D71 H80	K70-Q82 HydrophobicContact CB-CG 3.73Å; K70-Q82 HydrophobicContact CD-CG 3.95Å; K70-Q82 HydrophobicContact CG-CG 4.49Å; D71-Q82 WeakPolarHBondContact O-CA 3.33Å; D71-Q82 WeakPolarHBondContact O-CB 3.36Å; D71-Q82 PolarHBondContact O-N 3.12Å; H80-Q82 VanDerWaalsContact C-N 3.29Å; H80-Q82 PolarHBondContact O-N 2.97Å
83	F	95	Very high	93.7	Very high	18 Å²	18	76.1 Å²	76.1	8%	0.079	37%	0.374	C	S	.	.			trans	-148.7	165.4	177.2	59.7	-97.2	0	0	0	111.6	Q81 R86 C103 V152 E181	Q81-F83 VanDerWaalsContact C-N 3.33Å; Q81-F83 PolarHBondContact O-N 3.46Å; F83-R86 HydrophobicContact CD1-CB 4.19Å; F83-R86 HydrophobicContact CD2-CB 3.64Å; F83-R86 HydrophobicContact CE1-CB 4.04Å; F83-R86 HydrophobicContact CE1-CG 4.43Å; F83-R86 HydrophobicContact CE2-CB 3.49Å; F83-R86 VanDerWaalsContact CE2-CB 3.49Å; F83-R86 HydrophobicContact CG-CB 4Å; F83-R86 HydrophobicContact CZ-CB 3.71Å; F83-R86 HydrophobicContact CZ-CG 4.42Å; F83-C103 HydrophobicContact CD2-CB 4.31Å; F83-C103 HydrophobicContact CE2-CB 4.17Å; F83-C103 WeakPolarHBondContact O-CB 3.26Å; F83-V152 HydrophobicContact CB-CB 4.1Å; F83-V152 HydrophobicContact CB-CG2 3.79Å; F83-E181 VanDerWaalsContact CA-OE2 3.31Å; F83-E181 WeakPolarHBondContact CA-OE2 3.19Å
84	Y	95.6	Very high	94	Very high	9 Å²	9	82.4 Å²	82.4	4%	0.035	38%	0.383	C	S	.	.	S	Bend	trans	-96	-48	164.3	-56.6	-51.2	0	0	0	110.3	E63 A68 K70 S102 C103 E181	E63-Y84 HydrophobicContact CB-CD1 4.47Å; E63-Y84 HydrophobicContact CB-CD2 4.34Å; E63-Y84 HydrophobicContact CB-CG 4.25Å; E63-Y84 HydrophobicContact CG-CD1 4.04Å; E63-Y84 HydrophobicContact CG-CE1 4.49Å; E63-Y84 HydrophobicContact CG-CG 4.19Å; A68-Y84 HydrophobicContact CB-CD1 4.23Å; A68-Y84 HydrophobicContact CB-CE1 3.43Å; A68-Y84 VanDerWaalsContact CB-CE1 3.43Å; A68-Y84 WeakPolarHBondContact O-CE1 3.4Å; A68-Y84 PolarHBondContact O-OH 3.26Å; K70-Y84 HydrophobicContact CD-CE1 4.22Å; K70-Y84 HydrophobicContact CG-CD1 3.93Å; K70-Y84 HydrophobicContact CG-CE1 3.41Å; K70-Y84 VanDerWaalsContact CG-CE1 3.41Å; Y84-S102 CarbonylContact O-C 3.5Å; Y84-S102 WeakPolarHBondContact O-CA 3.4Å; Y84-C103 PolarHBondContact O-N 3.49Å; Y84-E181 WeakPolarHBondContact CA-OE1 3.34Å; Y84-E181 WeakPolarHBondContact CB-OE1 3.41Å; Y84-E181 VanDerWaalsContact N-CD 3.3Å; Y84-E181 PolarHBondContact N-OE1 2.9Å; Y84-E181 PolarHBondContact N-OE2 2.91Å
85	H	96.9	Very high	94.4	Very high	14 Å²	14	79.1 Å²	79.1	7%	0.065	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	132.5	174.9	-60.2	-54.2	0	0	0	110.8	E63 V100 F101 I148 M151 V152 E181	E63-H85 IonicContact OE2-NE2 3.8Å; H85-V100 HydrophobicContact CB-CG1 4.2Å; H85-F101 CarbonylContact C-O 3.53Å; H85-F101 VanDerWaalsContact CA-O 3.23Å; H85-F101 WeakPolarHBondContact CA-O 3.33Å; H85-I148 HydrophobicContact CB-CG2 4.37Å; H85-M151 HydrophobicContact CB-CB 3.88Å; H85-M151 CarbonylContact O-C 3.52Å; H85-M151 WeakPolarHBondContact O-CA 3.38Å; H85-M151 WeakPolarHBondContact O-CB 3.44Å; H85-V152 PolarHBondContact O-N 3.35Å; H85-E181 PolarHBondContact N-OE1 3.01Å; H85-E181 VanDerWaalsContact O-OE1 3.12Å
86	R	96.3	Very high	94.7	Very high	70 Å²	70	70.2 Å²	70.2	26%	0.264	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	127.9	176.9	-179.4	177.9	68.3	145.8	2.9	110.2	F83 V100 F101 V152	F83-R86 HydrophobicContact CD1-CB 4.19Å; F83-R86 HydrophobicContact CD2-CB 3.64Å; F83-R86 HydrophobicContact CE1-CB 4.04Å; F83-R86 HydrophobicContact CE1-CG 4.43Å; F83-R86 HydrophobicContact CE2-CB 3.49Å; F83-R86 VanDerWaalsContact CE2-CB 3.49Å; F83-R86 HydrophobicContact CG-CB 4Å; F83-R86 HydrophobicContact CZ-CB 3.71Å; F83-R86 HydrophobicContact CZ-CG 4.42Å; R86-V100 WeakPolarHBondContact O-CA 3.16Å; R86-F101 PolarHBondContact N-O 3.42Å; R86-F101 PolarHBondContact O-N 3.14Å; R86-V152 WeakPolarHBondContact CA-O 3.44Å
87	L	97.4	Very high	94.9	Very high	2 Å²	2	64.6 Å²	64.6	1%	0.01	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	125.8	170.6	-175.5	62	0	0	0	109.7	V100 L139 M151 V152 Y153 F168 M172 L179	L87-V100 HydrophobicContact CD1-CG2 3.87Å; L87-L139 HydrophobicContact CD1-CD2 3.66Å; L87-M151 HydrophobicContact CB-CG 4.12Å; L87-M151 HydrophobicContact CB-SD 3.71Å; L87-M151 HydrophobicContact CD1-SD 3.95Å; L87-M151 HydrophobicContact CD2-SD 4.06Å; L87-M151 HydrophobicContact CG-SD 4.13Å; L87-V152 PolarHBondContact N-O 2.87Å; L87-Y153 HydrophobicContact CB-CD2 4.02Å; L87-Y153 HydrophobicContact CD2-CD2 3.92Å; L87-Y153 HydrophobicContact CD2-CG 4.31Å; L87-Y153 HydrophobicContact CG-CD2 3.92Å; L87-Y153 WeakPolarHBondContact O-CD2 3.42Å; L87-F168 HydrophobicContact CD1-CZ 4.18Å; L87-F168 HydrophobicContact CD2-CE1 3.74Å; L87-F168 HydrophobicContact CD2-CZ 3.94Å; L87-F168 HydrophobicContact CG-CE1 4.32Å; L87-F168 HydrophobicContact CG-CZ 4.33Å; L87-M172 HydrophobicContact CD1-CE 4.33Å; L87-M172 HydrophobicContact CD2-CE 3.98Å; L87-M172 HydrophobicContact CD2-CG 4.42Å; L87-L179 HydrophobicContact CD2-CD2 3.62Å
88	M	96.6	Very high	95.1	Very high	80 Å²	80	61.3 Å²	61.3	39%	0.394	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	128.3	173.1	-172.1	162.7	176.2	0	0	108.9	A98 E99 F101	M88-A98 CarbonylContact O-C 2.88Å; M88-A98 WeakPolarHBondContact O-CA 3.37Å; M88-E99 PolarHBondContact N-O 3.37Å; M88-E99 PolarHBondContact O-N 2.87Å; M88-F101 HydrophobicContact CB-CD2 4.13Å; M88-F101 HydrophobicContact CB-CE2 3.9Å; M88-F101 HydrophobicContact SD-CE2 3.95Å
89	F	97.1	Very high	95.5	Very high	31 Å²	31	57 Å²	57	14%	0.136	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	124.5	175.3	174.5	-95	0	0	0	108	R91 V96 A98 C132 Y153 V165 F168	F89-R91 HydrophobicContact CE1-CB 4.25Å; F89-V96 HydrophobicContact CD2-CG1 4.27Å; F89-V96 HydrophobicContact CE2-CG1 3.33Å; F89-V96 HydrophobicContact CZ-CG1 3.69Å; F89-A98 HydrophobicContact CD2-CB 4.36Å; F89-C132 HydrophobicContact CE2-CB 4.41Å; F89-C132 HydrophobicContact CZ-CB 4.19Å; F89-Y153 HydrophobicContact CB-CE2 3.83Å; F89-V165 HydrophobicContact CD1-CG2 3.77Å; F89-V165 HydrophobicContact CE1-CG2 3.56Å; F89-F168 HydrophobicContact CB-CD1 4.27Å; F89-F168 HydrophobicContact CB-CE1 3.92Å; F89-F168 HydrophobicContact CB-CZ 4.41Å; F89-F168 HydrophobicContact CD2-CB 4.36Å; F89-F168 AromaticContact CD2-CD1 3.66Å; F89-F168 HydrophobicContact CD2-CD1 3.66Å; F89-F168 AromaticContact CD2-CD2 3.78Å; F89-F168 HydrophobicContact CD2-CD2 3.78Å; F89-F168 AromaticContact CD2-CE1 3.8Å; F89-F168 HydrophobicContact CD2-CE1 3.8Å; F89-F168 AromaticContact CD2-CE2 3.92Å; F89-F168 HydrophobicContact CD2-CE2 3.92Å; F89-F168 AromaticContact CD2-CG 3.65Å; F89-F168 HydrophobicContact CD2-CG 3.65Å; F89-F168 AromaticContact CD2-CZ 3.93Å; F89-F168 HydrophobicContact CD2-CZ 3.93Å; F89-F168 HydrophobicContact CE2-CB 4.02Å; F89-F168 HydrophobicContact CE2-CD1 4.19Å; F89-F168 AromaticContact CE2-CD2 3.86Å; F89-F168 HydrophobicContact CE2-CD2 3.86Å; F89-F168 HydrophobicContact CE2-CE2 4.39Å; F89-F168 AromaticContact CE2-CG 3.75Å; F89-F168 HydrophobicContact CE2-CG 3.75Å; F89-F168 HydrophobicContact CG-CD1 4.03Å; F89-F168 HydrophobicContact CG-CE1 4.12Å; F89-F168 HydrophobicContact CG-CG 4.42Å; F89-F168 HydrophobicContact CZ-CB 4.49Å
90	S	95.8	Very high	95.8	Very high	39 Å²	39	55.3 Å²	55.3	27%	0.273	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	134.3	179.5	51.4	0	0	0	0	109.9	T97	S90-T97 PolarHBondContact N-O 3.06Å; S90-T97 PolarHBondContact O-N 3.08Å; S90-T97 PolarHBondContact O-OG1 3.48Å; S90-T97 VanDerWaalsContact O-OG1 3.09Å; S90-T97 PolarHBondContact OG-O 2.89Å; S90-T97 PolarHBondContact OG-OG1 3.26Å
91	R	95.2	Very high	96.2	Very high	144 Å²	144	53.6 Å²	53.6	54%	0.543	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	112.9	177.4	-171.5	172.7	82.7	133.8	-1.5	108.5	F89 V96 N127	F89-R91 HydrophobicContact CE1-CB 4.25Å; R91-V96 HydrophobicContact CG-CG2 4.12Å; R91-N127 WeakPolarHBondContact CD-OD1 3.49Å; R91-N127 WeakPolarHBondContact CG-OD1 3.24Å
92	S	95.2	Very high	96.3	Very high	58 Å²	58	51 Å²	51	41%	0.406	24%	0.236	S	C	.	.			trans	-89.1	-179.9	172.1	70.3	0	0	0	0	110.5	R94 H95 N127	S92-R94 VanDerWaalsContact C-N 3.25Å; S92-R94 PolarHBondContact O-N 2.69Å; S92-H95 PolarHBondContact N-O 3.18Å; S92-H95 WeakPolarHBondContact OG-CA 3.41Å; S92-H95 PolarHBondContact OG-N 2.75Å; S92-H95 PolarHBondContact OG-O 2.95Å; S92-N127 PolarHBondContact O-ND2 2.83Å
93	Q	94.9	Very high	96.3	Very high	173 Å²	173	49.3 Å²	49.3	81%	0.808	23%	0.233	S	C	*	.	S	Bend	trans	-63.2	-30.2	177.5	-169.7	178.5	24.5	0	0	113.4	N127	Q93-N127 VanDerWaalsContact C-ND2 3.3Å; Q93-N127 PolarHBondContact O-ND2 2.81Å
94	R	95.1	Very high	96	Very high	179 Å²	179	54.1 Å²	54.1	68%	0.675	26%	0.264	S	S	*	.	S	Bend	trans	-115.2	-26.2	-175.3	-63.9	-175	-174.1	-179.1	1.3	113.8	S92 T126	S92-R94 VanDerWaalsContact C-N 3.25Å; S92-R94 PolarHBondContact O-N 2.69Å; R94-T126 CarbonylContact O-C 3.56Å; R94-T126 VanDerWaalsContact O-CB 3.24Å; R94-T126 WeakPolarHBondContact O-CB 3.35Å; R94-T126 PolarHBondContact O-OG1 3.37Å
95	H	97.1	Very high	95.8	Very high	40 Å²	40	56.1 Å²	56.1	19%	0.185	28%	0.279	C	S	.	.			trans	-136.1	144.5	-169.3	-61.7	-65.4	0	0	0	112.3	S92 T114 K115	S92-H95 PolarHBondContact N-O 3.18Å; S92-H95 WeakPolarHBondContact OG-CA 3.41Å; S92-H95 PolarHBondContact OG-N 2.75Å; S92-H95 PolarHBondContact OG-O 2.95Å; H95-T114 WeakPolarHBondContact CA-OG1 3.45Å; H95-T114 WeakPolarHBondContact CB-OG1 3.32Å; H95-T114 PolarHBondContact ND1-OG1 2.98Å; H95-K115 HydrophobicContact CB-CG 4.18Å
96	V	98	Very high	95.5	Very high	0 Å²	0	61 Å²	61	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	137.4	166.2	-176.1	0	0	0	0	109.5	F89 R91 S113 T114 T126 V135	F89-V96 HydrophobicContact CD2-CG1 4.27Å; F89-V96 HydrophobicContact CE2-CG1 3.33Å; F89-V96 HydrophobicContact CZ-CG1 3.69Å; R91-V96 HydrophobicContact CG-CG2 4.12Å; V96-S113 WeakPolarHBondContact O-CA 3.38Å; V96-S113 PolarHBondContact O-OG 3.33Å; V96-T114 HydrophobicContact CB-CG2 4.03Å; V96-T114 PolarHBondContact N-OG1 3Å; V96-T114 PolarHBondContact O-N 3.42Å; V96-T114 PolarHBondContact O-OG1 3.18Å; V96-T114 VanDerWaalsContact O-OG1 3.12Å; V96-T126 PolarHBondContact N-O 3.18Å; V96-V135 HydrophobicContact CB-CG2 4.42Å; V96-V135 HydrophobicContact CG1-CB 4.45Å; V96-V135 HydrophobicContact CG1-CG1 4.39Å; V96-V135 HydrophobicContact CG1-CG2 4.32Å
97	T	98.1	Very high	95.5	Very high	24 Å²	24	62.2 Å²	62.2	15%	0.147	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	134	-179.6	32	0	0	0	0	109.6	S90 S113	S90-T97 PolarHBondContact N-O 3.06Å; S90-T97 PolarHBondContact O-N 3.08Å; S90-T97 PolarHBondContact O-OG1 3.48Å; S90-T97 VanDerWaalsContact O-OG1 3.09Å; S90-T97 PolarHBondContact OG-O 2.89Å; S90-T97 PolarHBondContact OG-OG1 3.26Å; T97-S113 WeakPolarHBondContact CG2-OG 3.47Å
98	A	98.1	Very high	95.4	Very high	0 Å²	0	64 Å²	64	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	134.3	174.8	0	0	0	0	0	109.8	M88 F89 T111 C112 V135 L139 F168	M88-A98 CarbonylContact O-C 2.88Å; M88-A98 WeakPolarHBondContact O-CA 3.37Å; F89-A98 HydrophobicContact CD2-CB 4.36Å; A98-T111 CarbonylContact O-C 3.51Å; A98-T111 WeakPolarHBondContact O-CA 3.32Å; A98-C112 PolarHBondContact N-O 3.02Å; A98-C112 PolarHBondContact O-N 3.21Å; A98-V135 HydrophobicContact CB-CG1 3.62Å; A98-L139 HydrophobicContact CB-CD2 3.6Å; A98-F168 HydrophobicContact CB-CE2 3.67Å; A98-F168 HydrophobicContact CB-CZ 3.78Å
99	E	97.8	Very high	95.4	Very high	53 Å²	53	63.8 Å²	63.8	25%	0.248	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	141.5	-169.1	-58.5	-179.6	147.3	0	0	110	M88 F101 P108 L110 T111	M88-E99 PolarHBondContact N-O 3.37Å; M88-E99 PolarHBondContact O-N 2.87Å; E99-F101 HydrophobicContact CB-CD2 4.34Å; E99-F101 HydrophobicContact CB-CE2 3.66Å; E99-F101 HydrophobicContact CB-CZ 4.2Å; E99-F101 WeakPolarHBondContact OE2-CZ 3.32Å; E99-P108 HydrophobicContact CB-CB 4.11Å; E99-L110 CarbonylContact C-O 3.56Å; E99-L110 WeakPolarHBondContact CA-O 3.48Å; E99-T111 HydrophobicContact CB-CG2 4.5Å; E99-T111 HydrophobicContact CG-CG2 4.05Å
100	V	97.9	Very high	95.4	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	114.3	177.1	-177.4	0	0	0	0	108.5	H85 R86 L87 P108 V109 L110 L139 M151	H85-V100 HydrophobicContact CB-CG1 4.2Å; R86-V100 WeakPolarHBondContact O-CA 3.16Å; L87-V100 HydrophobicContact CD1-CG2 3.87Å; V100-P108 CarbonylContact O-C 3.58Å; V100-P108 WeakPolarHBondContact O-CA 3.24Å; V100-V109 PolarHBondContact O-N 3.16Å; V100-L110 HydrophobicContact CB-CB 4.18Å; V100-L110 HydrophobicContact CG2-CB 4.29Å; V100-L110 PolarHBondContact N-O 2.89Å; V100-L110 PolarHBondContact O-N 3.27Å; V100-L139 HydrophobicContact CG2-CD1 4.33Å; V100-L139 HydrophobicContact CG2-CD2 4.28Å; V100-M151 HydrophobicContact CG1-CE 4.3Å; V100-M151 HydrophobicContact CG2-CE 4.15Å; V100-M151 HydrophobicContact CG2-SD 4.09Å
101	F	96.8	Very high	95.5	Very high	27 Å²	27	64.7 Å²	64.7	12%	0.118	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	144.4	177.9	-68.3	-88.7	0	0	0	111	H85 R86 M88 E99 P106 P108	H85-F101 CarbonylContact C-O 3.53Å; H85-F101 VanDerWaalsContact CA-O 3.23Å; H85-F101 WeakPolarHBondContact CA-O 3.33Å; R86-F101 PolarHBondContact N-O 3.42Å; R86-F101 PolarHBondContact O-N 3.14Å; M88-F101 HydrophobicContact CB-CD2 4.13Å; M88-F101 HydrophobicContact CB-CE2 3.9Å; M88-F101 HydrophobicContact SD-CE2 3.95Å; E99-F101 HydrophobicContact CB-CD2 4.34Å; E99-F101 HydrophobicContact CB-CE2 3.66Å; E99-F101 HydrophobicContact CB-CZ 4.2Å; E99-F101 WeakPolarHBondContact OE2-CZ 3.32Å; F101-P106 WeakPolarHBondContact CD1-O 3.41Å; F101-P106 VanDerWaalsContact CE1-O 3.22Å; F101-P106 WeakPolarHBondContact CE1-O 3.42Å; F101-P108 HydrophobicContact CD1-CB 4.18Å; F101-P108 HydrophobicContact CE1-CB 3.88Å; F101-P108 HydrophobicContact CE1-CG 4.21Å; F101-P108 HydrophobicContact CE2-CB 4.46Å; F101-P108 HydrophobicContact CZ-CB 4.03Å; F101-P108 HydrophobicContact CZ-CG 4.38Å
102	S	94.8	Very high	95.7	Very high	20 Å²	20	57.9 Å²	57.9	14%	0.14	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	156.6	165	-177.8	0	0	0	0	110	Y84 T104 S105	Y84-S102 CarbonylContact O-C 3.5Å; Y84-S102 WeakPolarHBondContact O-CA 3.4Å; S102-T104 PolarHBondContact O-N 2.93Å; S102-T104 PolarHBondContact OG-N 3.41Å; S102-S105 VanDerWaalsContact O-O 3.12Å
103	C	92.2	Very high	95.8	Very high	55 Å²	55	55.8 Å²	55.8	37%	0.372	31%	0.307	S	S	.	.	S	Bend	trans	-66.2	-25.3	172	58.3	0	0	0	0	113	F83 Y84	F83-C103 HydrophobicContact CD2-CB 4.31Å; F83-C103 HydrophobicContact CE2-CB 4.17Å; F83-C103 WeakPolarHBondContact O-CB 3.26Å; Y84-C103 PolarHBondContact O-N 3.49Å
104	T	89.8	Confident	96	Very high	119 Å²	119	47.5 Å²	47.5	73%	0.73	27%	0.268	S	S	*	.	S	Bend	trans	-85.9	-28.9	-174.5	-47.8	0	0	0	0	113.2	S102	S102-T104 PolarHBondContact O-N 2.93Å; S102-T104 PolarHBondContact OG-N 3.41Å
105	S	90.4	Very high	96.1	Very high	50 Å²	50	45.8 Å²	45.8	35%	0.35	27%	0.266	S	S	.	.			trans	-123.7	137	-171.5	-179.2	0	0	0	0	111.2	S102 V107	S102-S105 VanDerWaalsContact O-O 3.12Å; S105-V107 PolarHBondContact O-N 3.24Å; S105-V107 PolarHBondContact OG-N 2.89Å; S105-V107 VanDerWaalsContact OG-N 3.12Å
106	P	91	Very high	96.1	Very high	117 Å²	117	46.3 Å²	46.3	76%	0.76	27%	0.268	S	S	*	.	S	Bend	trans	-73.2	-9.9	170.8	32.4	-35.7	0	0	0	112.7	F101	F101-P106 WeakPolarHBondContact CD1-O 3.41Å; F101-P106 VanDerWaalsContact CE1-O 3.22Å; F101-P106 WeakPolarHBondContact CE1-O 3.42Å
107	V	95.8	Very high	96	Very high	95 Å²	95	55.4 Å²	55.4	58%	0.576	30%	0.303	S	S	*	.	S	Bend	trans	-87.8	133.9	178.6	-177.2	0	0	0	0	109.4	S105 V109	S105-V107 PolarHBondContact O-N 3.24Å; S105-V107 PolarHBondContact OG-N 2.89Å; S105-V107 VanDerWaalsContact OG-N 3.12Å; V107-V109 PolarHBondContact O-N 2.82Å
108	P	97	Very high	96	Very high	39 Å²	39	57 Å²	57	25%	0.253	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	135.7	178.3	28.2	-33.8	0	0	0	110.9	E99 V100 F101 T111	E99-P108 HydrophobicContact CB-CB 4.11Å; V100-P108 CarbonylContact O-C 3.58Å; V100-P108 WeakPolarHBondContact O-CA 3.24Å; F101-P108 HydrophobicContact CD1-CB 4.18Å; F101-P108 HydrophobicContact CE1-CB 3.88Å; F101-P108 HydrophobicContact CE1-CG 4.21Å; F101-P108 HydrophobicContact CE2-CB 4.46Å; F101-P108 HydrophobicContact CZ-CB 4.03Å; F101-P108 HydrophobicContact CZ-CG 4.38Å; P108-T111 HydrophobicContact CB-CG2 3.68Å; P108-T111 HydrophobicContact CG-CG2 3.48Å; P108-T111 VanDerWaalsContact CG-CG2 3.48Å
109	V	96	Very high	95.9	Very high	76 Å²	76	57.5 Å²	57.5	46%	0.461	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	-40.6	176.8	-177.6	0	0	0	0	110.6	V100 V107 I148	V100-V109 PolarHBondContact O-N 3.16Å; V107-V109 PolarHBondContact O-N 2.82Å; V109-I148 HydrophobicContact CG1-CD1 3.92Å
110	L	97.4	Very high	95.9	Very high	30 Å²	30	60.1 Å²	60.1	16%	0.157	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	141.4	175.9	-63	174.1	0	0	0	109.1	E99 V100 L139 C143 A146 I148	E99-L110 CarbonylContact C-O 3.56Å; E99-L110 WeakPolarHBondContact CA-O 3.48Å; V100-L110 HydrophobicContact CB-CB 4.18Å; V100-L110 HydrophobicContact CG2-CB 4.29Å; V100-L110 PolarHBondContact N-O 2.89Å; V100-L110 PolarHBondContact O-N 3.27Å; L110-L139 HydrophobicContact CB-CD1 4.12Å; L110-C143 HydrophobicContact CD1-CB 4.22Å; L110-C143 VanDerWaalsContact CD1-SG 3.54Å; L110-A146 HydrophobicContact CD1-CB 3.92Å; L110-A146 HydrophobicContact CD2-CB 4.22Å; L110-I148 HydrophobicContact CD1-CD1 3.94Å; L110-I148 HydrophobicContact CG-CD1 4.35Å
111	T	97.8	Very high	95.8	Very high	60 Å²	60	65.5 Å²	65.5	37%	0.368	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	152.6	175.5	57.5	0	0	0	0	109	A98 E99 P108 R142	A98-T111 CarbonylContact O-C 3.51Å; A98-T111 WeakPolarHBondContact O-CA 3.32Å; E99-T111 HydrophobicContact CB-CG2 4.5Å; E99-T111 HydrophobicContact CG-CG2 4.05Å; P108-T111 HydrophobicContact CB-CG2 3.68Å; P108-T111 HydrophobicContact CG-CG2 3.48Å; P108-T111 VanDerWaalsContact CG-CG2 3.48Å; T111-R142 PolarHBondContact O-NH1 3.03Å
112	C	98	Very high	95.8	Very high	1 Å²	1	70.9 Å²	70.9	1%	0.007	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	125.6	168.3	-175.5	0	0	0	0	108.6	A98 E116 V135 L139	A98-C112 PolarHBondContact N-O 3.02Å; A98-C112 PolarHBondContact O-N 3.21Å; C112-E116 WeakPolarHBondContact CA-OE1 3.42Å; C112-V135 HydrophobicContact CB-CG1 4.2Å; C112-L139 HydrophobicContact CB-CB 3.91Å; C112-L139 HydrophobicContact CB-CD1 3.99Å; C112-L139 HydrophobicContact CB-CG 4.44Å
113	S	97.9	Very high	95.9	Very high	13 Å²	13	71.4 Å²	71.4	9%	0.091	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	146.9	178.7	-173	0	0	0	0	112.7	V96 T97 K115 E116	V96-S113 WeakPolarHBondContact O-CA 3.38Å; V96-S113 PolarHBondContact O-OG 3.33Å; T97-S113 WeakPolarHBondContact CG2-OG 3.47Å; S113-K115 PolarHBondContact O-N 2.86Å; S113-K115 VanDerWaalsContact O-N 3.13Å; S113-K115 WeakPolarHBondContact OG-CB 3.48Å; S113-K115 WeakPolarHBondContact OG-CG 3.13Å; S113-K115 PolarHBondContact OG-N 3.05Å; S113-E116 PolarHBondContact N-OE1 3.43Å; S113-E116 VanDerWaalsContact O-CB 3.26Å; S113-E116 WeakPolarHBondContact O-CB 3.47Å; S113-E116 WeakPolarHBondContact O-CG 3.19Å; S113-E116 PolarHBondContact O-N 3.47Å
114	T	98.1	Very high	96	Very high	0 Å²	0	74.3 Å²	74.3	0%	0	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-5.3	164.4	55.9	0	0	0	0	113.9	H95 V96 E116 L123 T126 A131 V135	H95-T114 WeakPolarHBondContact CA-OG1 3.45Å; H95-T114 WeakPolarHBondContact CB-OG1 3.32Å; H95-T114 PolarHBondContact ND1-OG1 2.98Å; V96-T114 HydrophobicContact CB-CG2 4.03Å; V96-T114 PolarHBondContact N-OG1 3Å; V96-T114 PolarHBondContact O-N 3.42Å; V96-T114 PolarHBondContact O-OG1 3.18Å; V96-T114 VanDerWaalsContact O-OG1 3.12Å; T114-E116 VanDerWaalsContact C-N 3.32Å; T114-L123 HydrophobicContact CG2-CD1 3.87Å; T114-T126 PolarHBondContact OG1-O 3.06Å; T114-A131 HydrophobicContact CG2-CB 4.16Å; T114-V135 HydrophobicContact CG2-CG2 3.69Å
115	K	97.1	Very high	96.4	Very high	143 Å²	143	71.4 Å²	71.4	62%	0.622	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-25.8	167	-65.8	178.2	-178.8	178.7	0	112.2	H95 S113 W117	H95-K115 HydrophobicContact CB-CG 4.18Å; S113-K115 PolarHBondContact O-N 2.86Å; S113-K115 VanDerWaalsContact O-N 3.13Å; S113-K115 WeakPolarHBondContact OG-CB 3.48Å; S113-K115 WeakPolarHBondContact OG-CG 3.13Å; S113-K115 PolarHBondContact OG-N 3.05Å; K115-W117 PolarHBondContact O-N 3.48Å
116	E	97.6	Very high	96.7	Very high	50 Å²	50	70.3 Å²	70.3	23%	0.234	39%	0.386	C	S	.	.	S	Bend	trans	-67.5	129	177.2	-61.6	173.3	-150.7	0	0	109.6	C112 S113 T114 A118 V119 K120 R142	C112-E116 WeakPolarHBondContact CA-OE1 3.42Å; S113-E116 PolarHBondContact N-OE1 3.43Å; S113-E116 VanDerWaalsContact O-CB 3.26Å; S113-E116 WeakPolarHBondContact O-CB 3.47Å; S113-E116 WeakPolarHBondContact O-CG 3.19Å; S113-E116 PolarHBondContact O-N 3.47Å; T114-E116 VanDerWaalsContact C-N 3.32Å; E116-A118 VanDerWaalsContact C-N 3.27Å; E116-A118 PolarHBondContact O-N 2.75Å; E116-V119 HydrophobicContact CB-CG2 4.39Å; E116-V119 PolarHBondContact O-N 3.42Å; E116-K120 WeakPolarHBondContact O-CB 3.34Å; E116-K120 PolarHBondContact O-N 3.37Å; E116-R142 IonicContact OE1-NH1 3Å; E116-R142 PolarHBondContact OE1-NH1 3.01Å; E116-R142 IonicContact OE2-CZ 3.32Å; E116-R142 VanDerWaalsContact OE2-CZ 3.32Å; E116-R142 IonicContact OE2-NH1 3.02Å; E116-R142 PolarHBondContact OE2-NH1 2.83Å; E116-R142 IonicContact OE2-NH2 2.68Å; E116-R142 PolarHBondContact OE2-NH2 2.89Å
117	W	97.1	Very high	96.9	Very high	192 Å²	192	66.6 Å²	66.6	73%	0.727	36%	0.359	S	S	*	.	H	α-helix	trans	-58.5	-39.4	-176.3	-179.7	86.5	0	0	0	112.7	K115 V119 K120 K121	K115-W117 PolarHBondContact O-N 3.48Å; W117-V119 VanDerWaalsContact C-N 3.28Å; W117-V119 PolarHBondContact O-N 3.17Å; W117-K120 PolarHBondContact O-N 3.31Å; W117-K121 HydrophobicContact CD2-CD 4.28Å; W117-K121 HydrophobicContact CE3-CD 3.89Å; W117-K121 HydrophobicContact CH2-CD 3.48Å; W117-K121 VanDerWaalsContact CH2-CD 3.48Å; W117-K121 HydrophobicContact CZ2-CD 3.89Å; W117-K121 HydrophobicContact CZ3-CD 3.48Å; W117-K121 VanDerWaalsContact CZ3-CD 3.48Å; W117-K121 PolarHBondContact O-N 2.93Å
118	A	97.1	Very high	96.9	Very high	56 Å²	56	64.2 Å²	64.2	46%	0.463	35%	0.347	S	S	.	.	H	α-helix	trans	-61.4	-34.6	-179.5	0	0	0	0	0	113.3	E116 K121	E116-A118 VanDerWaalsContact C-N 3.27Å; E116-A118 PolarHBondContact O-N 2.75Å; A118-K121 WeakPolarHBondContact O-CG 3.39Å
119	V	96.7	Very high	96.9	Very high	11 Å²	11	65 Å²	65	7%	0.067	35%	0.35	C	S	.	.	H	α-helix	trans	-82.5	-42	175.4	-179.7	0	0	0	0	109.8	E116 W117 K121 E122 L123 V135 V138	E116-V119 HydrophobicContact CB-CG2 4.39Å; E116-V119 PolarHBondContact O-N 3.42Å; W117-V119 VanDerWaalsContact C-N 3.28Å; W117-V119 PolarHBondContact O-N 3.17Å; V119-K121 VanDerWaalsContact C-N 3.33Å; V119-K121 PolarHBondContact O-N 3.42Å; V119-E122 PolarHBondContact O-N 3.43Å; V119-L123 HydrophobicContact CG1-CD1 3.71Å; V119-L123 HydrophobicContact CG1-CG 4.46Å; V119-L123 WeakPolarHBondContact O-CG 3.4Å; V119-V135 HydrophobicContact CG1-CG2 4.46Å; V119-V138 HydrophobicContact CG2-CG1 4.49Å
120	K	97	Very high	97	Very high	109 Å²	109	64.1 Å²	64.1	47%	0.474	35%	0.351	S	S	.	.	H	α-helix	trans	-61.2	-37.7	-176.8	-170.9	177.8	177.5	-172.4	0	113	E116 W117 E122 L123 T126	E116-K120 WeakPolarHBondContact O-CB 3.34Å; E116-K120 PolarHBondContact O-N 3.37Å; W117-K120 PolarHBondContact O-N 3.31Å; K120-E122 VanDerWaalsContact C-N 3.3Å; K120-E122 PolarHBondContact O-N 2.99Å; K120-L123 PolarHBondContact O-N 3.05Å; K120-T126 HydrophobicContact CD-CG2 4.47Å; K120-T126 HydrophobicContact CG-CG2 3.95Å
121	K	97.2	Very high	97	Very high	112 Å²	112	62.7 Å²	62.7	49%	0.487	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-28.8	-178.4	70.7	-175.6	176.1	89.3	0	114	W117 A118 V119 L123	W117-K121 HydrophobicContact CD2-CD 4.28Å; W117-K121 HydrophobicContact CE3-CD 3.89Å; W117-K121 HydrophobicContact CH2-CD 3.48Å; W117-K121 VanDerWaalsContact CH2-CD 3.48Å; W117-K121 HydrophobicContact CZ2-CD 3.89Å; W117-K121 HydrophobicContact CZ3-CD 3.48Å; W117-K121 VanDerWaalsContact CZ3-CD 3.48Å; W117-K121 PolarHBondContact O-N 2.93Å; A118-K121 WeakPolarHBondContact O-CG 3.39Å; V119-K121 VanDerWaalsContact C-N 3.33Å; V119-K121 PolarHBondContact O-N 3.42Å; K121-L123 VanDerWaalsContact C-N 3.33Å
122	E	96.3	Very high	97	Very high	140 Å²	140	59.8 Å²	59.8	65%	0.654	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-9.1	-179.4	-58	-58.1	145.7	0	0	112.1	V119 K120	V119-E122 PolarHBondContact O-N 3.43Å; K120-E122 VanDerWaalsContact C-N 3.3Å; K120-E122 PolarHBondContact O-N 2.99Å
123	L	96.5	Very high	97	Very high	31 Å²	31	63.5 Å²	63.5	16%	0.162	34%	0.343	C	S	.	.			trans	-107.4	130	-174.2	-67.8	175.4	0	0	0	111.7	T114 V119 K120 K121 S125 A131 A134	T114-L123 HydrophobicContact CG2-CD1 3.87Å; V119-L123 HydrophobicContact CG1-CD1 3.71Å; V119-L123 HydrophobicContact CG1-CG 4.46Å; V119-L123 WeakPolarHBondContact O-CG 3.4Å; K120-L123 PolarHBondContact O-N 3.05Å; K121-L123 VanDerWaalsContact C-N 3.33Å; L123-S125 VanDerWaalsContact C-N 3.28Å; L123-S125 PolarHBondContact O-N 2.82Å; L123-A131 HydrophobicContact CD1-CB 3.84Å; L123-A131 HydrophobicContact CD2-CB 4.37Å; L123-A134 HydrophobicContact CD2-CB 3.82Å
124	A	95.3	Very high	97.1	Very high	117 Å²	117	63.9 Å²	63.9	97%	0.967	35%	0.347	S	S	*	.	S	Bend	trans	-66.8	-30.2	171.2	0	0	0	0	0	112.7
125	S	96.3	Very high	97.1	Very high	58 Å²	58	63.9 Å²	63.9	41%	0.406	35%	0.347	S	S	.	.			trans	-146.9	145.7	177.6	177.1	0	0	0	0	110.7	L123 C128 A131	L123-S125 VanDerWaalsContact C-N 3.28Å; L123-S125 PolarHBondContact O-N 2.82Å; S125-C128 PolarHBondContact O-SG 3.01Å; S125-C128 VanDerWaalsContact O-SG 3.4Å; S125-A131 WeakPolarHBondContact O-CB 3.33Å
126	T	96.7	Very high	97.1	Very high	27 Å²	27	57.1 Å²	57.1	17%	0.166	32%	0.317	C	S	.	.	S	Bend	trans	-91.8	-0.9	-173.8	51	0	0	0	0	114.5	R94 V96 T114 K120	R94-T126 CarbonylContact O-C 3.56Å; R94-T126 VanDerWaalsContact O-CB 3.24Å; R94-T126 WeakPolarHBondContact O-CB 3.35Å; R94-T126 PolarHBondContact O-OG1 3.37Å; V96-T126 PolarHBondContact N-O 3.18Å; T114-T126 PolarHBondContact OG1-O 3.06Å; K120-T126 HydrophobicContact CD-CG2 4.47Å; K120-T126 HydrophobicContact CG-CG2 3.95Å
127	N	95.4	Very high	97.1	Very high	39 Å²	39	59 Å²	59	21%	0.209	33%	0.326	C	S	.	.	S	Bend	trans	-132.4	8.3	-179	-164.6	10.2	0	0	0	114.2	R91 S92 Q93	R91-N127 WeakPolarHBondContact CD-OD1 3.49Å; R91-N127 WeakPolarHBondContact CG-OD1 3.24Å; S92-N127 PolarHBondContact O-ND2 2.83Å; Q93-N127 VanDerWaalsContact C-ND2 3.3Å; Q93-N127 PolarHBondContact O-ND2 2.81Å
128	C	96.3	Very high	97.2	Very high	45 Å²	45	52.1 Å²	52.1	30%	0.304	31%	0.306	S	S	.	.	S	Bend	trans	-77.7	170.4	176.2	63.7	0	0	0	0	112	S125 A130 A131 C132	S125-C128 PolarHBondContact O-SG 3.01Å; S125-C128 VanDerWaalsContact O-SG 3.4Å; C128-A130 VanDerWaalsContact C-N 3.28Å; C128-A130 PolarHBondContact O-N 2.86Å; C128-A131 WeakPolarHBondContact O-CB 3.12Å; C128-A131 PolarHBondContact O-N 2.91Å; C128-A131 PolarHBondContact SG-N 3.45Å; C128-A131 VanDerWaalsContact SG-N 3.37Å; C128-C132 PolarHBondContact O-N 3.03Å; C128-C132 PolarHBondContact O-SG 2.95Å; C128-C132 VanDerWaalsContact O-SG 3.37Å
129	V	97.6	Very high	97.3	Very high	55 Å²	55	49.5 Å²	49.5	33%	0.333	28%	0.284	S	S	.	.	H	α-helix	trans	-61.2	-38.9	175.6	177.5	0	0	0	0	111	A131 C132 Q133 E163 A167	V129-A131 VanDerWaalsContact C-N 3.3Å; V129-A131 PolarHBondContact O-N 2.81Å; V129-C132 WeakPolarHBondContact O-CA 3.29Å; V129-C132 WeakPolarHBondContact O-CB 3.18Å; V129-C132 PolarHBondContact O-N 2.85Å; V129-Q133 PolarHBondContact O-N 3.46Å; V129-E163 HydrophobicContact CG1-CB 4.49Å; V129-E163 HydrophobicContact CG2-CB 4.08Å; V129-A167 HydrophobicContact CG1-CB 3.65Å
130	A	97.6	Very high	97.3	Very high	57 Å²	57	49 Å²	49	47%	0.471	28%	0.28	S	S	.	.	H	α-helix	trans	-60.7	-37	175.1	0	0	0	0	0	112.5	C128 C132 Q133 A134	C128-A130 VanDerWaalsContact C-N 3.28Å; C128-A130 PolarHBondContact O-N 2.86Å; A130-C132 VanDerWaalsContact C-N 3.33Å; A130-C132 PolarHBondContact O-N 3.43Å; A130-Q133 PolarHBondContact O-N 2.66Å; A130-A134 WeakPolarHBondContact O-CB 3.4Å; A130-A134 PolarHBondContact O-N 3.09Å
131	A	97.9	Very high	97.4	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-64.8	-38	173.5	0	0	0	0	0	112.1	T114 L123 S125 C128 V129 V135	T114-A131 HydrophobicContact CG2-CB 4.16Å; L123-A131 HydrophobicContact CD1-CB 3.84Å; L123-A131 HydrophobicContact CD2-CB 4.37Å; S125-A131 WeakPolarHBondContact O-CB 3.33Å; C128-A131 WeakPolarHBondContact O-CB 3.12Å; C128-A131 PolarHBondContact O-N 2.91Å; C128-A131 PolarHBondContact SG-N 3.45Å; C128-A131 VanDerWaalsContact SG-N 3.37Å; V129-A131 VanDerWaalsContact C-N 3.3Å; V129-A131 PolarHBondContact O-N 2.81Å; A131-V135 WeakPolarHBondContact O-CB 3.38Å; A131-V135 VanDerWaalsContact O-CG2 3.24Å; A131-V135 WeakPolarHBondContact O-CG2 3.33Å; A131-V135 PolarHBondContact O-N 3.28Å
132	C	98	Very high	97.4	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-65.2	-41	175.3	-57.3	0	0	0	0	111.2	F89 C128 V129 A130 G136 G164 F168	F89-C132 HydrophobicContact CE2-CB 4.41Å; F89-C132 HydrophobicContact CZ-CB 4.19Å; C128-C132 PolarHBondContact O-N 3.03Å; C128-C132 PolarHBondContact O-SG 2.95Å; C128-C132 VanDerWaalsContact O-SG 3.37Å; V129-C132 WeakPolarHBondContact O-CA 3.29Å; V129-C132 WeakPolarHBondContact O-CB 3.18Å; V129-C132 PolarHBondContact O-N 2.85Å; A130-C132 VanDerWaalsContact C-N 3.33Å; A130-C132 PolarHBondContact O-N 3.43Å; C132-G136 PolarHBondContact O-N 3.07Å; C132-G136 VanDerWaalsContact O-N 3.14Å; C132-G164 WeakPolarHBondContact CB-O 3.23Å; C132-F168 HydrophobicContact CB-CB 4.35Å; C132-F168 WeakPolarHBondContact O-CD2 3.28Å
133	Q	98.3	Very high	97.5	Very high	79 Å²	79	40 Å²	40	37%	0.369	24%	0.239	S	C	.	.	H	α-helix	trans	-62.4	-52.8	174.8	-174.4	-175.9	-27.6	0	0	111.3	V129 A130 V135 G136 E137 A167 A171	V129-Q133 PolarHBondContact O-N 3.46Å; A130-Q133 PolarHBondContact O-N 2.66Å; Q133-V135 VanDerWaalsContact C-N 3.33Å; Q133-V135 PolarHBondContact O-N 2.82Å; Q133-G136 CarbonylContact O-C 3.58Å; Q133-G136 WeakPolarHBondContact O-CA 3.48Å; Q133-G136 PolarHBondContact O-N 3.15Å; Q133-E137 WeakPolarHBondContact CG-OE1 3.2Å; Q133-E137 PolarHBondContact NE2-OE1 2.79Å; Q133-E137 PolarHBondContact O-N 2.92Å; Q133-A167 HydrophobicContact CB-CB 4.3Å; Q133-A171 HydrophobicContact CG-CB 4.13Å
134	A	98.2	Very high	97.5	Very high	21 Å²	21	43.9 Å²	43.9	17%	0.174	26%	0.256	C	S	.	.	H	α-helix	trans	-59.5	-41	-179.3	0	0	0	0	0	112.6	L123 A130 G136 E137 V138	L123-A134 HydrophobicContact CD2-CB 3.82Å; A130-A134 WeakPolarHBondContact O-CB 3.4Å; A130-A134 PolarHBondContact O-N 3.09Å; A134-G136 VanDerWaalsContact C-N 3.27Å; A134-G136 PolarHBondContact O-N 3.32Å; A134-E137 PolarHBondContact O-N 3.05Å; A134-V138 WeakPolarHBondContact O-CG2 3.4Å; A134-V138 PolarHBondContact O-N 2.86Å
135	V	98.3	Very high	97.6	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-60.5	-39	172.7	167.3	0	0	0	0	111.2	V96 A98 C112 T114 V119 A131 Q133 L139 F168	V96-V135 HydrophobicContact CB-CG2 4.42Å; V96-V135 HydrophobicContact CG1-CB 4.45Å; V96-V135 HydrophobicContact CG1-CG1 4.39Å; V96-V135 HydrophobicContact CG1-CG2 4.32Å; A98-V135 HydrophobicContact CB-CG1 3.62Å; C112-V135 HydrophobicContact CB-CG1 4.2Å; T114-V135 HydrophobicContact CG2-CG2 3.69Å; V119-V135 HydrophobicContact CG1-CG2 4.46Å; A131-V135 WeakPolarHBondContact O-CB 3.38Å; A131-V135 VanDerWaalsContact O-CG2 3.24Å; A131-V135 WeakPolarHBondContact O-CG2 3.33Å; A131-V135 PolarHBondContact O-N 3.28Å; Q133-V135 VanDerWaalsContact C-N 3.33Å; Q133-V135 PolarHBondContact O-N 2.82Å; V135-L139 WeakPolarHBondContact O-CB 3.43Å; V135-L139 PolarHBondContact O-N 3.49Å; V135-F168 HydrophobicContact CG1-CE2 4.27Å
136	G	98.1	Very high	97.6	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-64.7	-44.6	175.1	0	0	0	0	0	112.9	C132 Q133 A134 L139 A140 F168 M172	C132-G136 PolarHBondContact O-N 3.07Å; C132-G136 VanDerWaalsContact O-N 3.14Å; Q133-G136 CarbonylContact O-C 3.58Å; Q133-G136 WeakPolarHBondContact O-CA 3.48Å; Q133-G136 PolarHBondContact O-N 3.15Å; A134-G136 VanDerWaalsContact C-N 3.27Å; A134-G136 PolarHBondContact O-N 3.32Å; G136-L139 PolarHBondContact O-N 3.33Å; G136-A140 VanDerWaalsContact O-CB 3.24Å; G136-A140 WeakPolarHBondContact O-CB 3.34Å; G136-A140 PolarHBondContact O-N 3.48Å; G136-F168 VanDerWaalsContact CA-CD2 3.45Å; G136-M172 VanDerWaalsContact O-SD 3.32Å
137	E	98.3	Very high	97.6	Very high	89 Å²	89	44.3 Å²	44.3	42%	0.416	24%	0.244	S	C	.	.	H	α-helix	trans	-63.1	-49.6	178.8	-67.9	172.4	-174.6	0	0	111.5	Q133 A134 L139 A140 H141 A171	Q133-E137 WeakPolarHBondContact CG-OE1 3.2Å; Q133-E137 PolarHBondContact NE2-OE1 2.79Å; Q133-E137 PolarHBondContact O-N 2.92Å; A134-E137 PolarHBondContact O-N 3.05Å; E137-L139 PolarHBondContact O-N 3.5Å; E137-A140 PolarHBondContact O-N 2.76Å; E137-H141 PolarHBondContact O-N 3.05Å; E137-A171 HydrophobicContact CG-CB 3.8Å
138	V	98.3	Very high	97.6	Very high	49 Å²	49	42.6 Å²	42.6	30%	0.297	24%	0.235	S	C	.	.	H	α-helix	trans	-63.1	-43.4	178.5	173.5	0	0	0	0	110.9	V119 A134 H141 R142	V119-V138 HydrophobicContact CG2-CG1 4.49Å; A134-V138 WeakPolarHBondContact O-CG2 3.4Å; A134-V138 PolarHBondContact O-N 2.86Å; V138-H141 PolarHBondContact O-N 3.12Å; V138-R142 WeakPolarHBondContact O-CG 3.48Å; V138-R142 PolarHBondContact O-N 3.41Å
139	L	98.3	Very high	97.5	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-66.5	-40.3	178.5	-175	64.3	0	0	0	111.6	L87 A98 V100 L110 C112 V135 G136 E137 H141 R142 C143 F168 M172	L87-L139 HydrophobicContact CD1-CD2 3.66Å; A98-L139 HydrophobicContact CB-CD2 3.6Å; V100-L139 HydrophobicContact CG2-CD1 4.33Å; V100-L139 HydrophobicContact CG2-CD2 4.28Å; L110-L139 HydrophobicContact CB-CD1 4.12Å; C112-L139 HydrophobicContact CB-CB 3.91Å; C112-L139 HydrophobicContact CB-CD1 3.99Å; C112-L139 HydrophobicContact CB-CG 4.44Å; V135-L139 WeakPolarHBondContact O-CB 3.43Å; V135-L139 PolarHBondContact O-N 3.49Å; G136-L139 PolarHBondContact O-N 3.33Å; E137-L139 PolarHBondContact O-N 3.5Å; L139-H141 VanDerWaalsContact C-N 3.32Å; L139-H141 PolarHBondContact O-N 2.99Å; L139-R142 PolarHBondContact O-N 2.87Å; L139-C143 WeakPolarHBondContact O-CB 3.42Å; L139-C143 PolarHBondContact O-N 2.58Å; L139-C143 PolarHBondContact O-SG 2.86Å; L139-F168 HydrophobicContact CD2-CE2 4.49Å; L139-F168 HydrophobicContact CD2-CZ 4.33Å; L139-M172 HydrophobicContact CB-SD 4.14Å; L139-M172 HydrophobicContact CD2-CE 4.35Å; L139-M172 HydrophobicContact CD2-SD 4.21Å; L139-M172 HydrophobicContact CG-CE 4.46Å; L139-M172 HydrophobicContact CG-SD 4.24Å
140	A	98.3	Very high	97.4	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-61.5	-42.7	176.6	0	0	0	0	0	111.5	G136 E137 C143 Q144 M172 V177	G136-A140 VanDerWaalsContact O-CB 3.24Å; G136-A140 WeakPolarHBondContact O-CB 3.34Å; G136-A140 PolarHBondContact O-N 3.48Å; E137-A140 PolarHBondContact O-N 2.76Å; A140-C143 WeakPolarHBondContact O-CB 3.22Å; A140-C143 PolarHBondContact O-N 3.13Å; A140-Q144 PolarHBondContact O-N 2.92Å; A140-M172 HydrophobicContact CB-SD 3.89Å; A140-V177 HydrophobicContact CB-CG2 4.08Å
141	H	97.9	Very high	97.4	Very high	103 Å²	103	44.4 Å²	44.4	48%	0.477	22%	0.221	S	C	.	.	H	α-helix	trans	-61.8	-45.9	174.4	-174.9	-97.8	0	0	0	112.2	E137 V138 L139 C143 Q144 Q145	E137-H141 PolarHBondContact O-N 3.05Å; V138-H141 PolarHBondContact O-N 3.12Å; L139-H141 VanDerWaalsContact C-N 3.32Å; L139-H141 PolarHBondContact O-N 2.99Å; H141-C143 VanDerWaalsContact C-N 3.28Å; H141-C143 PolarHBondContact O-N 3.3Å; H141-Q144 PolarHBondContact O-N 2.86Å; H141-Q145 VanDerWaalsContact CE1-CD 3.47Å; H141-Q145 PolarHBondContact CE1-NE2 3.17Å; H141-Q145 WeakPolarHBondContact O-CG 3.41Å; H141-Q145 PolarHBondContact O-N 3.41Å
142	R	98.3	Very high	97.3	Very high	69 Å²	69	45.5 Å²	45.5	26%	0.26	23%	0.228	S	C	.	.	H	α-helix	trans	-58.7	-40.9	173.3	-71.4	177	-177.1	178.8	4	111.7	T111 E116 V138 L139 Q145 A146	T111-R142 PolarHBondContact O-NH1 3.03Å; E116-R142 IonicContact OE1-NH1 3Å; E116-R142 PolarHBondContact OE1-NH1 3.01Å; E116-R142 IonicContact OE2-CZ 3.32Å; E116-R142 VanDerWaalsContact OE2-CZ 3.32Å; E116-R142 IonicContact OE2-NH1 3.02Å; E116-R142 PolarHBondContact OE2-NH1 2.83Å; E116-R142 IonicContact OE2-NH2 2.68Å; E116-R142 PolarHBondContact OE2-NH2 2.89Å; V138-R142 WeakPolarHBondContact O-CG 3.48Å; V138-R142 PolarHBondContact O-N 3.41Å; L139-R142 PolarHBondContact O-N 2.87Å; R142-Q145 PolarHBondContact O-N 3.12Å; R142-A146 WeakPolarHBondContact O-CB 3.28Å; R142-A146 PolarHBondContact O-N 3.19Å
143	C	97.9	Very high	97.2	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-64.3	-40.3	177.1	-69.4	0	0	0	0	112	L110 L139 A140 H141 A146 G147 I148 M151 V177	L110-C143 HydrophobicContact CD1-CB 4.22Å; L110-C143 VanDerWaalsContact CD1-SG 3.54Å; L139-C143 WeakPolarHBondContact O-CB 3.42Å; L139-C143 PolarHBondContact O-N 2.58Å; L139-C143 PolarHBondContact O-SG 2.86Å; A140-C143 WeakPolarHBondContact O-CB 3.22Å; A140-C143 PolarHBondContact O-N 3.13Å; H141-C143 VanDerWaalsContact C-N 3.28Å; H141-C143 PolarHBondContact O-N 3.3Å; C143-A146 CarbonylContact O-C 3.56Å; C143-A146 PolarHBondContact O-N 3.41Å; C143-G147 PolarHBondContact O-N 2.98Å; C143-I148 WeakPolarHBondContact CB-O 3.36Å; C143-I148 PolarHBondContact O-N 3.43Å; C143-M151 HydrophobicContact CB-CE 4.34Å; C143-V177 HydrophobicContact CB-CG2 3.99Å
144	Q	96.8	Very high	96.9	Very high	114 Å²	114	48 Å²	48	53%	0.533	23%	0.234	S	C	.	.	H	α-helix	trans	-64.3	-46	176.4	-169.4	174.9	20.3	0	0	111.3	A140 H141 A146 G147 M149	A140-Q144 PolarHBondContact O-N 2.92Å; H141-Q144 PolarHBondContact O-N 2.86Å; Q144-A146 VanDerWaalsContact C-N 3.32Å; Q144-A146 PolarHBondContact O-N 3.43Å; Q144-G147 PolarHBondContact O-N 3.37Å; Q144-M149 HydrophobicContact CB-SD 4.38Å; Q144-M149 HydrophobicContact CG-SD 4.28Å
145	Q	97.4	Very high	96.6	Very high	143 Å²	143	48 Å²	48	67%	0.668	23%	0.233	S	C	*	.	H	α-helix	trans	-61.7	-38.2	175.5	-68.8	-178.8	-30.4	0	0	112.5	H141 R142 G147	H141-Q145 VanDerWaalsContact CE1-CD 3.47Å; H141-Q145 PolarHBondContact CE1-NE2 3.17Å; H141-Q145 WeakPolarHBondContact O-CG 3.41Å; H141-Q145 PolarHBondContact O-N 3.41Å; R142-Q145 PolarHBondContact O-N 3.12Å; Q145-G147 VanDerWaalsContact C-N 3.26Å; Q145-G147 PolarHBondContact O-N 3.3Å
146	A	96.2	Very high	96.3	Very high	39 Å²	39	50.7 Å²	50.7	32%	0.322	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-6.2	175.5	0	0	0	0	0	114.1	R60 L110 R142 C143 Q144 I148	R60-A146 PolarHBondContact NH1-O 3.31Å; L110-A146 HydrophobicContact CD1-CB 3.92Å; L110-A146 HydrophobicContact CD2-CB 4.22Å; R142-A146 WeakPolarHBondContact O-CB 3.28Å; R142-A146 PolarHBondContact O-N 3.19Å; C143-A146 CarbonylContact O-C 3.56Å; C143-A146 PolarHBondContact O-N 3.41Å; Q144-A146 VanDerWaalsContact C-N 3.32Å; Q144-A146 PolarHBondContact O-N 3.43Å; A146-I148 HydrophobicContact CB-CD1 4.24Å; A146-I148 HydrophobicContact CB-CG1 4.16Å; A146-I148 PolarHBondContact O-N 2.87Å
147	G	95.7	Very high	96	Very high	29 Å²	29	55.2 Å²	55.2	30%	0.299	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.7	37.7	-174.6	0	0	0	0	0	113.4	R60 C143 Q144 Q145	R60-G147 PolarHBondContact NH2-O 3.34Å; C143-G147 PolarHBondContact O-N 2.98Å; Q144-G147 PolarHBondContact O-N 3.37Å; Q145-G147 VanDerWaalsContact C-N 3.26Å; Q145-G147 PolarHBondContact O-N 3.3Å
148	I	95.9	Very high	95.6	Very high	3 Å²	3	59.2 Å²	59.2	2%	0.015	29%	0.288	C	S	.	.			trans	-108.2	84.5	173.8	-54.7	176.4	0	0	0	108.6	H85 V109 L110 C143 A146 M151	H85-I148 HydrophobicContact CB-CG2 4.37Å; V109-I148 HydrophobicContact CG1-CD1 3.92Å; L110-I148 HydrophobicContact CD1-CD1 3.94Å; L110-I148 HydrophobicContact CG-CD1 4.35Å; C143-I148 WeakPolarHBondContact CB-O 3.36Å; C143-I148 PolarHBondContact O-N 3.43Å; A146-I148 HydrophobicContact CB-CD1 4.24Å; A146-I148 HydrophobicContact CB-CG1 4.16Å; A146-I148 PolarHBondContact O-N 2.87Å; I148-M151 HydrophobicContact CG2-CE 3.79Å
149	M	95.3	Very high	95.4	Very high	70 Å²	70	58.9 Å²	58.9	35%	0.345	29%	0.286	S	S	.	.			trans	-91.1	-18.4	-174.5	-58.3	-53.3	-65.1	0	0	114	Q144 G176 I178	Q144-M149 HydrophobicContact CB-SD 4.38Å; Q144-M149 HydrophobicContact CG-SD 4.28Å; M149-G176 WeakPolarHBondContact CE-O 3.48Å; M149-I178 PolarHBondContact O-N 3.03Å
150	R	95.8	Very high	95.1	Very high	124 Å²	124	61.5 Å²	61.5	47%	0.468	30%	0.297	S	S	.	.	B	Isolated β-bridge	trans	-129.4	129.7	-174.2	-56.1	-171.5	-179.9	-119.8	2	109.9	I178	R150-I178 WeakPolarHBondContact CA-O 3.49Å; R150-I178 HydrophobicContact CG-CB 4.33Å
151	M	96.5	Very high	94.9	Very high	0 Å²	0	71.2 Å²	71.2	0%	0	33%	0.333	C	S	.	.			trans	-155.3	158	179.7	60.4	-170.1	68.1	0	0	109.9	H85 L87 V100 C143 I148 M172 V177 I178 L179 S180	H85-M151 HydrophobicContact CB-CB 3.88Å; H85-M151 CarbonylContact O-C 3.52Å; H85-M151 WeakPolarHBondContact O-CA 3.38Å; H85-M151 WeakPolarHBondContact O-CB 3.44Å; L87-M151 HydrophobicContact CB-CG 4.12Å; L87-M151 HydrophobicContact CB-SD 3.71Å; L87-M151 HydrophobicContact CD1-SD 3.95Å; L87-M151 HydrophobicContact CD2-SD 4.06Å; L87-M151 HydrophobicContact CG-SD 4.13Å; V100-M151 HydrophobicContact CG1-CE 4.3Å; V100-M151 HydrophobicContact CG2-CE 4.15Å; V100-M151 HydrophobicContact CG2-SD 4.09Å; C143-M151 HydrophobicContact CB-CE 4.34Å; I148-M151 HydrophobicContact CG2-CE 3.79Å; M151-M172 HydrophobicContact CE-CE 4.33Å; M151-M172 HydrophobicContact SD-CE 3.89Å; M151-V177 HydrophobicContact CE-CG1 3.58Å; M151-V177 HydrophobicContact CG-CG1 4.03Å; M151-V177 HydrophobicContact SD-CG1 3.93Å; M151-I178 PolarHBondContact N-O 3.04Å; M151-I178 VanDerWaalsContact N-O 3.13Å; M151-L179 HydrophobicContact CG-CD2 4.21Å; M151-L179 CarbonylContact O-C 3.54Å; M151-L179 WeakPolarHBondContact O-CA 3.28Å; M151-S180 PolarHBondContact O-N 3.16Å
152	V	96.3	Very high	94.8	Very high	23 Å²	23	68.3 Å²	68.3	14%	0.139	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	126.7	176.5	177	0	0	0	0	109.9	F83 H85 R86 L87 R154 E181	F83-V152 HydrophobicContact CB-CB 4.1Å; F83-V152 HydrophobicContact CB-CG2 3.79Å; H85-V152 PolarHBondContact O-N 3.35Å; R86-V152 WeakPolarHBondContact CA-O 3.44Å; L87-V152 PolarHBondContact N-O 2.87Å; V152-R154 HydrophobicContact CG1-CG 3.83Å; V152-E181 HydrophobicContact CG2-CB 4.15Å; V152-E181 HydrophobicContact CG2-CG 3.79Å
153	Y	95.8	Very high	94.8	Very high	18 Å²	18	71.7 Å²	71.7	7%	0.071	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	111.5	167.9	-178.7	-110.3	0	0	0	110.4	L87 F89 A155 Y160 V165 R169	L87-Y153 HydrophobicContact CB-CD2 4.02Å; L87-Y153 HydrophobicContact CD2-CD2 3.92Å; L87-Y153 HydrophobicContact CD2-CG 4.31Å; L87-Y153 HydrophobicContact CG-CD2 3.92Å; L87-Y153 WeakPolarHBondContact O-CD2 3.42Å; F89-Y153 HydrophobicContact CB-CE2 3.83Å; Y153-A155 HydrophobicContact CE1-CB 4.06Å; Y153-Y160 AromaticContact CD1-CE1 3.71Å; Y153-Y160 HydrophobicContact CD1-CE1 3.71Å; Y153-Y160 HydrophobicContact CE1-CD1 4.18Å; Y153-Y160 AromaticContact CE1-CE1 3.43Å; Y153-Y160 HydrophobicContact CE1-CE1 3.43Å; Y153-Y160 VanDerWaalsContact CE1-CE1 3.43Å; Y153-Y160 AromaticContact CE1-CZ 3.97Å; Y153-Y160 PolarHBondContact O-OH 3.12Å; Y153-Y160 VanDerWaalsContact O-OH 3.12Å; Y153-V165 HydrophobicContact CE1-CG1 4.18Å; Y153-V165 WeakPolarHBondContact OH-CG1 3.14Å; Y153-R169 HydrophobicContact CD1-CG 4.11Å; Y153-R169 HydrophobicContact CE1-CG 3.92Å
154	R	91.7	Very high	94.7	Very high	115 Å²	115	72 Å²	72	43%	0.434	35%	0.346	S	S	.	.			trans	-121.9	123.1	173.6	-73.3	-173.2	-172.8	-144.7	11.3	109.6	H80 V152 Y160	H80-R154 PolarHBondContact CD2-NH1 3.31Å; V152-R154 HydrophobicContact CG1-CG 3.83Å; R154-Y160 WeakPolarHBondContact CA-OH 3.17Å
155	A	90.9	Very high	94.7	Very high	19 Å²	19	66.9 Å²	66.9	16%	0.157	32%	0.323	C	S	.	.			trans	-127.9	172.5	171.9	0	0	0	0	0	109.3	Y153 T159 Y160	Y153-A155 HydrophobicContact CE1-CB 4.06Å; A155-T159 WeakPolarHBondContact CB-OG1 3.43Å; A155-Y160 HydrophobicContact CB-CD2 4.34Å; A155-Y160 HydrophobicContact CB-CE1 4.43Å; A155-Y160 HydrophobicContact CB-CE2 3.83Å; A155-Y160 PolarHBondContact N-OH 2.9Å; A155-Y160 VanDerWaalsContact O-CE2 3.24Å; A155-Y160 WeakPolarHBondContact O-CE2 3.41Å
156	I	92.8	Very high	94.7	Very high	58 Å²	58	64.7 Å²	64.7	30%	0.297	31%	0.312	S	S	.	.			trans	-77.4	140.7	-179.9	-47.7	172	0	0	0	108.7	W78 W158 T159	W78-I156 HydrophobicContact CH2-CD1 4.42Å; W78-I156 HydrophobicContact CH2-CG1 3.63Å; W78-I156 HydrophobicContact CZ2-CG1 3.85Å; W78-I156 HydrophobicContact CZ3-CG1 4.25Å; I156-W158 VanDerWaalsContact C-N 3.3Å; I156-W158 HydrophobicContact CB-CD2 4.35Å; I156-W158 HydrophobicContact CB-CH2 4.44Å; I156-W158 HydrophobicContact CB-CZ2 4.04Å; I156-W158 HydrophobicContact CD1-CZ2 3.98Å; I156-W158 HydrophobicContact CG2-CD2 3.72Å; I156-W158 VanDerWaalsContact CG2-CE2 3.46Å; I156-W158 HydrophobicContact CG2-CE3 3.67Å; I156-W158 HydrophobicContact CG2-CH2 3.22Å; I156-W158 HydrophobicContact CG2-CZ2 3.25Å; I156-W158 HydrophobicContact CG2-CZ3 3.42Å; I156-W158 VanDerWaalsContact CG2-CZ3 3.42Å; I156-W158 PolarHBondContact O-N 3.39Å; I156-T159 HydrophobicContact CB-CG2 4.38Å; I156-T159 PolarHBondContact N-OG1 2.94Å; I156-T159 WeakPolarHBondContact O-CB 3.37Å; I156-T159 PolarHBondContact O-N 3.09Å; I156-T159 PolarHBondContact O-OG1 2.73Å
157	P	91.3	Very high	94.8	Very high	94 Å²	94	63.7 Å²	63.7	61%	0.61	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-47	-42.1	-169.2	-35	38.4	0	0	0	116.6	T159 Y160	P157-T159 VanDerWaalsContact C-N 3.33Å; P157-T159 PolarHBondContact O-N 3.41Å; P157-Y160 WeakPolarHBondContact O-CB 3.49Å; P157-Y160 PolarHBondContact O-N 2.76Å
158	W	91.6	Very high	94.9	Very high	174 Å²	174	62.3 Å²	62.3	66%	0.659	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-68.1	-28.5	179	53.1	87.2	0	0	0	113.8	I156 Y160 R161	I156-W158 VanDerWaalsContact C-N 3.3Å; I156-W158 HydrophobicContact CB-CD2 4.35Å; I156-W158 HydrophobicContact CB-CH2 4.44Å; I156-W158 HydrophobicContact CB-CZ2 4.04Å; I156-W158 HydrophobicContact CD1-CZ2 3.98Å; I156-W158 HydrophobicContact CG2-CD2 3.72Å; I156-W158 VanDerWaalsContact CG2-CE2 3.46Å; I156-W158 HydrophobicContact CG2-CE3 3.67Å; I156-W158 HydrophobicContact CG2-CH2 3.22Å; I156-W158 HydrophobicContact CG2-CZ2 3.25Å; I156-W158 HydrophobicContact CG2-CZ3 3.42Å; I156-W158 VanDerWaalsContact CG2-CZ3 3.42Å; I156-W158 PolarHBondContact O-N 3.39Å; W158-Y160 PolarHBondContact O-N 2.91Å; W158-R161 WeakPolarHBondContact O-CB 3.44Å; W158-R161 PolarHBondContact O-N 3.49Å
159	T	93.1	Very high	95	Very high	42 Å²	42	65.6 Å²	65.6	26%	0.258	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-65.3	-29.5	177.2	62.2	0	0	0	0	112.2	A155 I156 P157 R161 S162 V165	A155-T159 WeakPolarHBondContact CB-OG1 3.43Å; I156-T159 HydrophobicContact CB-CG2 4.38Å; I156-T159 PolarHBondContact N-OG1 2.94Å; I156-T159 WeakPolarHBondContact O-CB 3.37Å; I156-T159 PolarHBondContact O-N 3.09Å; I156-T159 PolarHBondContact O-OG1 2.73Å; P157-T159 VanDerWaalsContact C-N 3.33Å; P157-T159 PolarHBondContact O-N 3.41Å; T159-R161 PolarHBondContact O-N 3.2Å; T159-S162 WeakPolarHBondContact O-CB 3.24Å; T159-S162 PolarHBondContact O-N 3.19Å; T159-S162 VanDerWaalsContact O-N 3.15Å; T159-S162 PolarHBondContact O-OG 2.88Å; T159-V165 WeakPolarHBondContact O-CB 3.48Å; T159-V165 WeakPolarHBondContact O-CG2 3.36Å
160	Y	92.9	Very high	95.1	Very high	55 Å²	55	64.2 Å²	64.2	22%	0.216	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-67.6	-18.6	174.5	-71	-76.7	0	0	0	113.7	Y153 R154 A155 P157 W158 S162 V165 Q166 R169	Y153-Y160 AromaticContact CD1-CE1 3.71Å; Y153-Y160 HydrophobicContact CD1-CE1 3.71Å; Y153-Y160 HydrophobicContact CE1-CD1 4.18Å; Y153-Y160 AromaticContact CE1-CE1 3.43Å; Y153-Y160 HydrophobicContact CE1-CE1 3.43Å; Y153-Y160 VanDerWaalsContact CE1-CE1 3.43Å; Y153-Y160 AromaticContact CE1-CZ 3.97Å; Y153-Y160 PolarHBondContact O-OH 3.12Å; Y153-Y160 VanDerWaalsContact O-OH 3.12Å; R154-Y160 WeakPolarHBondContact CA-OH 3.17Å; A155-Y160 HydrophobicContact CB-CD2 4.34Å; A155-Y160 HydrophobicContact CB-CE1 4.43Å; A155-Y160 HydrophobicContact CB-CE2 3.83Å; A155-Y160 PolarHBondContact N-OH 2.9Å; A155-Y160 VanDerWaalsContact O-CE2 3.24Å; A155-Y160 WeakPolarHBondContact O-CE2 3.41Å; P157-Y160 WeakPolarHBondContact O-CB 3.49Å; P157-Y160 PolarHBondContact O-N 2.76Å; W158-Y160 PolarHBondContact O-N 2.91Å; Y160-S162 VanDerWaalsContact C-N 3.3Å; Y160-V165 HydrophobicContact CD1-CG1 4.39Å; Y160-Q166 VanDerWaalsContact O-CG 3.28Å; Y160-Q166 WeakPolarHBondContact O-CG 3.27Å; Y160-Q166 PolarHBondContact O-NE2 3.08Å; Y160-R169 VanDerWaalsContact CD1-NH1 3.25Å
161	R	93.6	Very high	95.2	Very high	204 Å²	204	58.4 Å²	58.4	77%	0.77	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-77.8	-17.4	175.2	-61.6	-176.2	178.1	168.8	-1.6	112.5	W158 T159 Q166	W158-R161 WeakPolarHBondContact O-CB 3.44Å; W158-R161 PolarHBondContact O-N 3.49Å; T159-R161 PolarHBondContact O-N 3.2Å; R161-Q166 PolarHBondContact O-NE2 3.24Å
162	S	95.8	Very high	95.3	Very high	42 Å²	42	58.4 Å²	58.4	29%	0.294	28%	0.28	S	S	.	.	S	Bend	trans	-71.8	133.1	179.2	71.1	0	0	0	0	111.3	T159 Y160 G164 V165 Q166	T159-S162 WeakPolarHBondContact O-CB 3.24Å; T159-S162 PolarHBondContact O-N 3.19Å; T159-S162 VanDerWaalsContact O-N 3.15Å; T159-S162 PolarHBondContact O-OG 2.88Å; Y160-S162 VanDerWaalsContact C-N 3.3Å; S162-G164 VanDerWaalsContact C-N 3.26Å; S162-G164 PolarHBondContact O-N 3.14Å; S162-V165 PolarHBondContact O-N 3.3Å; S162-V165 VanDerWaalsContact O-N 3.17Å; S162-V165 VanDerWaalsContact OG-CB 3.28Å; S162-V165 WeakPolarHBondContact OG-CB 3.49Å; S162-V165 WeakPolarHBondContact OG-CG2 3.39Å; S162-V165 PolarHBondContact OG-N 2.99Å; S162-Q166 WeakPolarHBondContact O-CG 3.47Å; S162-Q166 PolarHBondContact O-N 2.94Å
163	E	96.8	Very high	95.4	Very high	140 Å²	140	63.1 Å²	63.1	65%	0.654	30%	0.299	S	S	*	.	H	α-helix	trans	-59.3	-37.8	-180	-63.2	-174.1	151.7	0	0	112	V129 V165 Q166 A167	V129-E163 HydrophobicContact CG1-CB 4.49Å; V129-E163 HydrophobicContact CG2-CB 4.08Å; E163-V165 PolarHBondContact O-N 2.99Å; E163-Q166 PolarHBondContact O-N 3.12Å; E163-A167 WeakPolarHBondContact O-CB 3.42Å; E163-A167 PolarHBondContact O-N 2.9Å
164	G	96.8	Very high	95.5	Very high	6 Å²	6	69.5 Å²	69.5	6%	0.062	33%	0.329	C	S	.	.	H	α-helix	trans	-59.6	-43.5	176.2	0	0	0	0	0	113.2	C132 S162 F168	C132-G164 WeakPolarHBondContact CB-O 3.23Å; S162-G164 VanDerWaalsContact C-N 3.26Å; S162-G164 PolarHBondContact O-N 3.14Å; G164-F168 VanDerWaalsContact O-CB 3.29Å; G164-F168 WeakPolarHBondContact O-CB 3.22Å; G164-F168 PolarHBondContact O-N 3.35Å
165	V	97	Very high	95.7	Very high	6 Å²	6	65.2 Å²	65.2	4%	0.036	32%	0.321	C	S	.	.	H	α-helix	trans	-69.3	-37.1	176.1	170.4	0	0	0	0	111	F89 Y153 T159 Y160 S162 E163 R169	F89-V165 HydrophobicContact CD1-CG2 3.77Å; F89-V165 HydrophobicContact CE1-CG2 3.56Å; Y153-V165 HydrophobicContact CE1-CG1 4.18Å; Y153-V165 WeakPolarHBondContact OH-CG1 3.14Å; T159-V165 WeakPolarHBondContact O-CB 3.48Å; T159-V165 WeakPolarHBondContact O-CG2 3.36Å; Y160-V165 HydrophobicContact CD1-CG1 4.39Å; S162-V165 PolarHBondContact O-N 3.3Å; S162-V165 VanDerWaalsContact O-N 3.17Å; S162-V165 VanDerWaalsContact OG-CB 3.28Å; S162-V165 WeakPolarHBondContact OG-CB 3.49Å; S162-V165 WeakPolarHBondContact OG-CG2 3.39Å; S162-V165 PolarHBondContact OG-N 2.99Å; E163-V165 PolarHBondContact O-N 2.99Å; V165-R169 HydrophobicContact CG1-CG 4.34Å; V165-R169 WeakPolarHBondContact O-CB 3.33Å; V165-R169 WeakPolarHBondContact O-CG 3.46Å; V165-R169 PolarHBondContact O-N 2.8Å
166	Q	97.2	Very high	96	Very high	97 Å²	97	66.1 Å²	66.1	45%	0.453	33%	0.333	S	S	.	.	H	α-helix	trans	-65.3	-47.6	177.2	-68.6	176.2	8.8	0	0	111.7	Y160 R161 S162 E163 R169 A170	Y160-Q166 VanDerWaalsContact O-CG 3.28Å; Y160-Q166 WeakPolarHBondContact O-CG 3.27Å; Y160-Q166 PolarHBondContact O-NE2 3.08Å; R161-Q166 PolarHBondContact O-NE2 3.24Å; S162-Q166 WeakPolarHBondContact O-CG 3.47Å; S162-Q166 PolarHBondContact O-N 2.94Å; E163-Q166 PolarHBondContact O-N 3.12Å; Q166-R169 PolarHBondContact O-N 3.24Å; Q166-A170 WeakPolarHBondContact O-CB 3.43Å; Q166-A170 PolarHBondContact O-N 3.02Å
167	A	98.1	Very high	96.2	Very high	18 Å²	18	63.5 Å²	63.5	15%	0.149	32%	0.319	C	S	.	.	H	α-helix	trans	-60.7	-46.3	176.6	0	0	0	0	0	111.6	V129 Q133 E163 R169 A170 A171	V129-A167 HydrophobicContact CG1-CB 3.65Å; Q133-A167 HydrophobicContact CB-CB 4.3Å; E163-A167 WeakPolarHBondContact O-CB 3.42Å; E163-A167 PolarHBondContact O-N 2.9Å; A167-R169 PolarHBondContact O-N 3.22Å; A167-A170 PolarHBondContact O-N 3.35Å; A167-A171 WeakPolarHBondContact O-CB 3.39Å; A167-A171 PolarHBondContact O-N 3.32Å
168	F	98.1	Very high	96.5	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-57.7	-46.1	174.5	171.2	-101.2	0	0	0	112.4	L87 F89 A98 C132 V135 G136 L139 G164 A170 A171 M172	L87-F168 HydrophobicContact CD1-CZ 4.18Å; L87-F168 HydrophobicContact CD2-CE1 3.74Å; L87-F168 HydrophobicContact CD2-CZ 3.94Å; L87-F168 HydrophobicContact CG-CE1 4.32Å; L87-F168 HydrophobicContact CG-CZ 4.33Å; F89-F168 HydrophobicContact CB-CD1 4.27Å; F89-F168 HydrophobicContact CB-CE1 3.92Å; F89-F168 HydrophobicContact CB-CZ 4.41Å; F89-F168 HydrophobicContact CD2-CB 4.36Å; F89-F168 AromaticContact CD2-CD1 3.66Å; F89-F168 HydrophobicContact CD2-CD1 3.66Å; F89-F168 AromaticContact CD2-CD2 3.78Å; F89-F168 HydrophobicContact CD2-CD2 3.78Å; F89-F168 AromaticContact CD2-CE1 3.8Å; F89-F168 HydrophobicContact CD2-CE1 3.8Å; F89-F168 AromaticContact CD2-CE2 3.92Å; F89-F168 HydrophobicContact CD2-CE2 3.92Å; F89-F168 AromaticContact CD2-CG 3.65Å; F89-F168 HydrophobicContact CD2-CG 3.65Å; F89-F168 AromaticContact CD2-CZ 3.93Å; F89-F168 HydrophobicContact CD2-CZ 3.93Å; F89-F168 HydrophobicContact CE2-CB 4.02Å; F89-F168 HydrophobicContact CE2-CD1 4.19Å; F89-F168 AromaticContact CE2-CD2 3.86Å; F89-F168 HydrophobicContact CE2-CD2 3.86Å; F89-F168 HydrophobicContact CE2-CE2 4.39Å; F89-F168 AromaticContact CE2-CG 3.75Å; F89-F168 HydrophobicContact CE2-CG 3.75Å; F89-F168 HydrophobicContact CG-CD1 4.03Å; F89-F168 HydrophobicContact CG-CE1 4.12Å; F89-F168 HydrophobicContact CG-CG 4.42Å; F89-F168 HydrophobicContact CZ-CB 4.49Å; A98-F168 HydrophobicContact CB-CE2 3.67Å; A98-F168 HydrophobicContact CB-CZ 3.78Å; C132-F168 HydrophobicContact CB-CB 4.35Å; C132-F168 WeakPolarHBondContact O-CD2 3.28Å; V135-F168 HydrophobicContact CG1-CE2 4.27Å; G136-F168 VanDerWaalsContact CA-CD2 3.45Å; L139-F168 HydrophobicContact CD2-CE2 4.49Å; L139-F168 HydrophobicContact CD2-CZ 4.33Å; G164-F168 VanDerWaalsContact O-CB 3.29Å; G164-F168 WeakPolarHBondContact O-CB 3.22Å; G164-F168 PolarHBondContact O-N 3.35Å; F168-A170 VanDerWaalsContact C-N 3.35Å; F168-A170 PolarHBondContact O-N 3Å; F168-A171 PolarHBondContact O-N 2.86Å; F168-M172 HydrophobicContact CE1-CG 4.17Å; F168-M172 HydrophobicContact CE2-CG 4.14Å; F168-M172 HydrophobicContact CE2-SD 4.44Å; F168-M172 HydrophobicContact CZ-CG 3.91Å; F168-M172 HydrophobicContact CZ-SD 4.33Å; F168-M172 WeakPolarHBondContact O-CG 3.4Å; F168-M172 PolarHBondContact O-N 2.68Å
169	R	97.4	Very high	96.7	Very high	72 Å²	72	55.2 Å²	55.2	27%	0.272	28%	0.282	S	S	.	.	H	α-helix	trans	-66.4	-36.8	178.3	-72.6	171.7	74.3	-155	5.9	112.4	Y153 Y160 V165 Q166 A167 K173 L179	Y153-R169 HydrophobicContact CD1-CG 4.11Å; Y153-R169 HydrophobicContact CE1-CG 3.92Å; Y160-R169 VanDerWaalsContact CD1-NH1 3.25Å; V165-R169 HydrophobicContact CG1-CG 4.34Å; V165-R169 WeakPolarHBondContact O-CB 3.33Å; V165-R169 WeakPolarHBondContact O-CG 3.46Å; V165-R169 PolarHBondContact O-N 2.8Å; Q166-R169 PolarHBondContact O-N 3.24Å; A167-R169 PolarHBondContact O-N 3.22Å; R169-K173 WeakPolarHBondContact O-CG 3.49Å; R169-K173 PolarHBondContact O-N 3.42Å; R169-K173 VanDerWaalsContact O-N 3.14Å; R169-L179 HydrophobicContact CB-CD1 4.16Å; R169-L179 HydrophobicContact CG-CD1 4.05Å
170	A	98.1	Very high	96.8	Very high	41 Å²	41	56.5 Å²	56.5	34%	0.339	29%	0.292	S	S	.	.	H	α-helix	trans	-64	-48.4	176.4	0	0	0	0	0	110.3	Q166 A167 F168 M172 K173 Q174	Q166-A170 WeakPolarHBondContact O-CB 3.43Å; Q166-A170 PolarHBondContact O-N 3.02Å; A167-A170 PolarHBondContact O-N 3.35Å; F168-A170 VanDerWaalsContact C-N 3.35Å; F168-A170 PolarHBondContact O-N 3Å; A170-M172 PolarHBondContact O-N 3Å; A170-K173 PolarHBondContact O-N 3.03Å; A170-K173 VanDerWaalsContact O-N 3.16Å; A170-Q174 WeakPolarHBondContact O-CB 3.31Å; A170-Q174 WeakPolarHBondContact O-CG 3.5Å; A170-Q174 PolarHBondContact O-N 2.91Å
171	A	98.2	Very high	96.9	Very high	2 Å²	2	55.1 Å²	55.1	2%	0.017	29%	0.288	C	S	.	.	H	α-helix	trans	-56.1	-46.7	175.1	0	0	0	0	0	112.6	Q133 E137 A167 F168 K173 Q174 G175	Q133-A171 HydrophobicContact CG-CB 4.13Å; E137-A171 HydrophobicContact CG-CB 3.8Å; A167-A171 WeakPolarHBondContact O-CB 3.39Å; A167-A171 PolarHBondContact O-N 3.32Å; F168-A171 PolarHBondContact O-N 2.86Å; A171-K173 VanDerWaalsContact C-N 3.33Å; A171-K173 PolarHBondContact O-N 2.91Å; A171-Q174 PolarHBondContact O-N 2.91Å; A171-G175 PolarHBondContact O-N 3.32Å
172	M	98.1	Very high	96.9	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-59.4	-42.3	177	-73.5	-67.4	-68.4	0	0	112.7	L87 G136 L139 A140 M151 F168 A170 G175 V177 L179	L87-M172 HydrophobicContact CD1-CE 4.33Å; L87-M172 HydrophobicContact CD2-CE 3.98Å; L87-M172 HydrophobicContact CD2-CG 4.42Å; G136-M172 VanDerWaalsContact O-SD 3.32Å; L139-M172 HydrophobicContact CB-SD 4.14Å; L139-M172 HydrophobicContact CD2-CE 4.35Å; L139-M172 HydrophobicContact CD2-SD 4.21Å; L139-M172 HydrophobicContact CG-CE 4.46Å; L139-M172 HydrophobicContact CG-SD 4.24Å; A140-M172 HydrophobicContact CB-SD 3.89Å; M151-M172 HydrophobicContact CE-CE 4.33Å; M151-M172 HydrophobicContact SD-CE 3.89Å; F168-M172 HydrophobicContact CE1-CG 4.17Å; F168-M172 HydrophobicContact CE2-CG 4.14Å; F168-M172 HydrophobicContact CE2-SD 4.44Å; F168-M172 HydrophobicContact CZ-CG 3.91Å; F168-M172 HydrophobicContact CZ-SD 4.33Å; F168-M172 WeakPolarHBondContact O-CG 3.4Å; F168-M172 PolarHBondContact O-N 2.68Å; A170-M172 PolarHBondContact O-N 3Å; M172-G175 PolarHBondContact O-N 3.38Å; M172-V177 HydrophobicContact CE-CB 4.02Å; M172-V177 HydrophobicContact CE-CG1 3.85Å; M172-V177 HydrophobicContact CE-CG2 4.05Å; M172-V177 WeakPolarHBondContact O-CB 3.42Å; M172-V177 PolarHBondContact O-N 3.43Å; M172-L179 HydrophobicContact CB-CD2 4.31Å
173	K	98	Very high	96.8	Very high	123 Å²	123	54.6 Å²	54.6	54%	0.535	29%	0.29	S	S	.	.	H	α-helix	trans	-68.5	-40.8	177.5	-72.3	176.1	177.6	-173.5	0	112.2	R169 A170 A171 G175 G176	R169-K173 WeakPolarHBondContact O-CG 3.49Å; R169-K173 PolarHBondContact O-N 3.42Å; R169-K173 VanDerWaalsContact O-N 3.14Å; A170-K173 PolarHBondContact O-N 3.03Å; A170-K173 VanDerWaalsContact O-N 3.16Å; A171-K173 VanDerWaalsContact C-N 3.33Å; A171-K173 PolarHBondContact O-N 2.91Å; K173-G175 VanDerWaalsContact C-N 3.3Å; K173-G176 PolarHBondContact O-N 3.11Å
174	Q	98	Very high	96.7	Very high	151 Å²	151	51.3 Å²	51.3	71%	0.706	27%	0.272	S	S	*	.	H	α-helix	trans	-63.9	-37.2	176.5	-73.7	170.8	-7.6	0	0	111.4	A170 A171 G176	A170-Q174 WeakPolarHBondContact O-CB 3.31Å; A170-Q174 WeakPolarHBondContact O-CG 3.5Å; A170-Q174 PolarHBondContact O-N 2.91Å; A171-Q174 PolarHBondContact O-N 2.91Å; Q174-G176 PolarHBondContact O-N 3.4Å; Q174-G176 VanDerWaalsContact O-N 3.08Å
175	G	96.8	Very high	96.6	Very high	26 Å²	26	57.6 Å²	57.6	27%	0.268	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	11.2	171.1	0	0	0	0	0	114.8	A171 M172 K173 V177	A171-G175 PolarHBondContact O-N 3.32Å; M172-G175 PolarHBondContact O-N 3.38Å; K173-G175 VanDerWaalsContact C-N 3.3Å; G175-V177 PolarHBondContact O-N 2.77Å
176	G	96.7	Very high	96.4	Very high	38 Å²	38	64.3 Å²	64.3	39%	0.392	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.4	4.6	174.3	0	0	0	0	0	115.4	M149 K173 Q174	M149-G176 WeakPolarHBondContact CE-O 3.48Å; K173-G176 PolarHBondContact O-N 3.11Å; Q174-G176 PolarHBondContact O-N 3.4Å; Q174-G176 VanDerWaalsContact O-N 3.08Å
177	V	97.6	Very high	96	Very high	2 Å²	2	65.4 Å²	65.4	1%	0.012	34%	0.336	C	S	.	.			trans	-84.5	126	178.8	-176.5	0	0	0	0	110.8	A140 C143 M151 M172 G175 L179	A140-V177 HydrophobicContact CB-CG2 4.08Å; C143-V177 HydrophobicContact CB-CG2 3.99Å; M151-V177 HydrophobicContact CE-CG1 3.58Å; M151-V177 HydrophobicContact CG-CG1 4.03Å; M151-V177 HydrophobicContact SD-CG1 3.93Å; M172-V177 HydrophobicContact CE-CB 4.02Å; M172-V177 HydrophobicContact CE-CG1 3.85Å; M172-V177 HydrophobicContact CE-CG2 4.05Å; M172-V177 WeakPolarHBondContact O-CB 3.42Å; M172-V177 PolarHBondContact O-N 3.43Å; G175-V177 PolarHBondContact O-N 2.77Å; V177-L179 HydrophobicContact CG1-CD2 4.39Å
178	I	97.3	Very high	95.2	Very high	67 Å²	67	67.7 Å²	67.7	34%	0.344	36%	0.362	S	S	.	.	B	Isolated β-bridge	trans	-91.4	113.6	177.3	-54.4	174.2	0	0	0	108.6	M149 R150 M151 S180	M149-I178 PolarHBondContact O-N 3.03Å; R150-I178 WeakPolarHBondContact CA-O 3.49Å; R150-I178 HydrophobicContact CG-CB 4.33Å; M151-I178 PolarHBondContact N-O 3.04Å; M151-I178 VanDerWaalsContact N-O 3.13Å; I178-S180 WeakPolarHBondContact CG2-O 3.4Å; I178-S180 WeakPolarHBondContact CG2-OG 3.36Å; I178-S180 PolarHBondContact O-N 2.89Å
179	L	96.1	Very high	93.1	Very high	27 Å²	27	78.1 Å²	78.1	14%	0.141	43%	0.426	C	S	.	.	S	Bend	trans	-76.3	28.9	179.4	-57.7	-179.1	0	0	0	113.9	L87 M151 R169 M172 V177	L87-L179 HydrophobicContact CD2-CD2 3.62Å; M151-L179 HydrophobicContact CG-CD2 4.21Å; M151-L179 CarbonylContact O-C 3.54Å; M151-L179 WeakPolarHBondContact O-CA 3.28Å; R169-L179 HydrophobicContact CB-CD1 4.16Å; R169-L179 HydrophobicContact CG-CD1 4.05Å; M172-L179 HydrophobicContact CB-CD2 4.31Å; V177-L179 HydrophobicContact CG1-CD2 4.39Å
180	S	94.3	Very high	92.9	Very high	69 Å²	69	78.5 Å²	78.5	48%	0.483	43%	0.434	S	S	.	.	S	Bend	trans	-147.4	137.9	174.6	63.2	0	0	0	0	109.8	M151 I178	M151-S180 PolarHBondContact O-N 3.16Å; I178-S180 WeakPolarHBondContact CG2-O 3.4Å; I178-S180 WeakPolarHBondContact CG2-OG 3.36Å; I178-S180 PolarHBondContact O-N 2.89Å
181	E	94.5	Very high	92.6	Very high	26 Å²	26	80.4 Å²	80.4	12%	0.121	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-94	153.5	176.7	-72.3	-178.5	174	0	0	112.5	K70 F83 Y84 H85 V152	K70-E181 WeakPolarHBondContact CE-OE2 3.36Å; K70-E181 IonicContact NZ-OE2 2.73Å; K70-E181 PolarHBondContact NZ-OE2 2.68Å; F83-E181 VanDerWaalsContact CA-OE2 3.31Å; F83-E181 WeakPolarHBondContact CA-OE2 3.19Å; Y84-E181 WeakPolarHBondContact CA-OE1 3.34Å; Y84-E181 WeakPolarHBondContact CB-OE1 3.41Å; Y84-E181 VanDerWaalsContact N-CD 3.3Å; Y84-E181 PolarHBondContact N-OE1 2.9Å; Y84-E181 PolarHBondContact N-OE2 2.91Å; H85-E181 PolarHBondContact N-OE1 3.01Å; H85-E181 VanDerWaalsContact O-OE1 3.12Å; V152-E181 HydrophobicContact CG2-CB 4.15Å; V152-E181 HydrophobicContact CG2-CG 3.79Å
182	P	94.1	Very high	92.3	Very high	44 Å²	44	84.8 Å²	84.8	29%	0.286	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-63.8	152	171.7	29.5	-35	0	0	0	110.8	A66 K70	A66-P182 HydrophobicContact CB-CB 4.18Å; A66-P182 HydrophobicContact CB-CG 3.87Å; K70-P182 PolarHBondContact NZ-O 3.3Å
183	K	93.5	Very high	91.9	Very high	191 Å²	191	89.8 Å²	89.8	83%	0.83	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-65.6	143.2	167.8	-67.7	-177	-179.8	178	0	108.9	K185	K183-K185 PolarHBondContact O-N 3.35Å
184	R	94.4	Very high	91.6	Very high	71 Å²	71	87.7 Å²	87.7	27%	0.268	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-62.1	127.7	175.2	-179.4	-178.3	175.7	-157	-8.4	109.1	A66 L67 A68	A66-R184 CarbonylContact O-C 3.54Å; A66-R184 VanDerWaalsContact O-CA 3.28Å; A66-R184 WeakPolarHBondContact O-CA 3.24Å; L67-R184 PolarHBondContact O-NE 2.89Å; A68-R184 WeakPolarHBondContact O-CD 3.48Å
185	K	94.8	Very high	91.1	Very high	139 Å²	139	83.5 Å²	83.5	60%	0.604	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-79.8	142.9	171.1	-65.9	179.9	179.7	-178.5	0	109.3	A66 L67 K183	A66-K185 PolarHBondContact O-N 3.37Å; L67-K185 HydrophobicContact CD2-CB 3.86Å; K183-K185 PolarHBondContact O-N 3.35Å
186	Y	93.4	Very high	90.7	Very high	146 Å²	146	87.6 Å²	87.6	57%	0.573	49%	0.487	S	S	*	.			trans	-111.6	125	172.6	-65.6	-88.4	0	0	0	107.7	R72	R72-Y186 PolarHBondContact NH1-OH 2.69Å; R72-Y186 VanDerWaalsContact NH2-CZ 3.32Å; R72-Y186 PolarHBondContact NH2-OH 3.04Å
187	V	89.1	Confident	90.3	Very high	120 Å²	120	91.4 Å²	91.4	73%	0.727	49%	0.494	S	S	*	.			trans	-87.9	113.9	167.6	-175	0	0	0	0	104.7	L67	L67-V187 HydrophobicContact CD2-CG2 3.76Å
188	G	81.4	Confident	89.7	Confident	67 Å²	67	98.8 Å²	98.8	69%	0.691	53%	0.534	S	S	*	.			trans	-68.2	141.6	169.4	0	0	0	0	0	109.1
189	T	53.1	Low	89	Confident	219 Å²	219	101.7 Å²	101.7	100%	1.344	55%	0.552	S	S	*	*			trans	-75.3	0	161.1	42.5	0	0	0	0	110.1

Retrieved 189 of 189 residues in 1011.8 ms (Link to these results)

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